2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-N-[(4-methoxyphenyl)amino]-C-pyridin-3-yl-carbonimidoyl]imino-ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-N-[(4-methoxyphenyl)amino]-C-pyridin-3-yl-carbonimidoyl]imino-ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-N-(4-methoxyanilino)-C-(3-pyridyl)carbonimidoyl]imino-acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-[(4-methoxyphenyl)hydrazinylidene]-(3-pyridinyl)methyl]iminoacetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[(E)-N-(4-methoxyanilino)-C-pyridin-3-ylcarbonimidoyl]iminoacetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[(E)-N-(p-anisidino)-C-(3-pyridyl)carbonimidoyl]imino-acetamide Formula: C22H19N7O2S MolecularWeight: 445.49696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NN=C(C2=CN=CC=C2)N=NC(=O)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)N/N=C(\C2=CN=CC=C2)/N=NC(=O)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H19N7O2S/c1-31-17-10-8-16(9-11-17)26-28-21(15-5-4-12-23-13-15)29-27-20(30)14-32-22-24-18-6-2-3-7-19(18)25-22/h2-13,26H,14H2,1H3,(H,24,25)/b28-21+,29-27?