16682942 1 2 3 4 5 6 7 8 9 10 11 12 13 14 80 7 7 7 7 6 6 6 1 1 1 1 1 1 1 1 2 2 2 3 3 3 4 5 7 7 7 4 7 6 8 9 6 10 11 6 8 12 13 14 1 1 1 1 1 1 1 1 2 3 1 1 1 4 -1 1 6 2 3 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 2.5369 4.269 2.5369 3.403 6.001 3.403 2.5369 5.135 4.269 2 2.5369 1.9169 2.5369 3.1569 -0.81 1.19 1.19 -0.31 0.19 0.69 -1.81 0.69 1.81 0.88 1.81 -1.81 -2.43 -1.81 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 132 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0000037180438000000000000000000100000000000000000000000000000000000000000000001400100000000000000000030002C000003000000020000000000000000100000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(E)-[amino-(cyanoamino)methylene]amino]-methyl-mercury IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(E)-[amino-(cyanoamino)methylidene]amino]-methylmercury IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(<I>E</I>)-[amino-(cyanoamino)methylidene]amino]-methylmercury IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(E)-[amino-(cyanoamino)methylidene]amino]-methylmercury IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(E)-[azanyl-(cyanoamino)methylidene]amino]-methyl-mercury IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 [(E)-[amino-(cyanoamino)methylene]amino]-methyl-mercury InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/C2H3N4.CH3.Hg/c3-1-6-2(4)5;;/h(H3-,4,5,6);1H3;/q-1;;+1 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 JVJUWCMBRUMDDQ-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 300.029890 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 C3H6HgN4 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 298.70 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C[Hg]N=C(N)NC#N SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C[Hg]/N=C(\N)/NC#N Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 74.2 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 300.029890 8 0 0 0 1 1 0 0 1 3