60378875 -OEChem-03282419522D 39 41 0 0 0 0 0 0 0999 V2000 4.6783 3.3358 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 1.6651 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 0.7990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.7264 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7619 -3.5311 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 2.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 2.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 2.7431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 3.1417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.1511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 1.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 2.2756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 0.4699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -2.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8819 -0.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2249 -1.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4519 -2.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2988 -2.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 2 14 1 0 0 0 0 3 17 1 0 0 0 0 3 20 1 0 0 0 0 4 18 1 0 0 0 0 4 24 1 0 0 0 0 5 20 2 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 25 3 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 10 11 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 15 1 0 0 0 0 12 28 1 0 0 0 0 13 16 1 0 0 0 0 13 29 1 0 0 0 0 14 20 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 19 23 2 0 0 0 0 19 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END > 60378875 > 1 > 510 > 7 > 0 > 7 > AAADccB7MABgAAAAAAAAAAAAAAAAAWAAAAAwYAAAAAAAAFgB9AAAHgQAAAAADAyF3gKyz7IIFAi8ByTyTACj+KBhKjhImDw27JgNpqLksZuGOirkwBHq6A+QwBAOIAABAAAAQQBAAAIAAACCAAAAAAAAAA== > (4-cyano-2-methoxy-phenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate > 2-(1,3-benzothiazol-2-ylmethylthio)acetic acid (4-cyano-2-methoxyphenyl) ester > (4-cyano-2-methoxyphenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate > (4-cyano-2-methoxyphenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetate > (4-cyano-2-methoxy-phenyl) 2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoate > 2-(1,3-benzothiazol-2-ylmethylthio)acetic acid (4-cyano-2-methoxy-phenyl) ester > InChI=1S/C18H14N2O3S2/c1-22-15-8-12(9-19)6-7-14(15)23-18(21)11-24-10-17-20-13-4-2-3-5-16(13)25-17/h2-8H,10-11H2,1H3 > BIABJUFXBIAAFM-UHFFFAOYSA-N > 4 > 370.04458466 > C18H14N2O3S2 > 370.4 > COC1=C(C=CC(=C1)C#N)OC(=O)CSCC2=NC3=CC=CC=C3S2 > COC1=C(C=CC(=C1)C#N)OC(=O)CSCC2=NC3=CC=CC=C3S2 > 126 > 370.04458466 > 0 > 25 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 10 8 1 8 8 12 15 8 13 16 8 15 16 8 17 18 8 17 19 8 18 21 8 19 23 8 21 22 8 22 23 8 6 10 8 6 9 8 8 12 8 8 9 8 9 13 8 $$$$