N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-2-(4-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-2-(4-methylphenyl)sulfanyl-ethanamide Openeye Name: N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]-2-(p-tolylsulfanyl)acetamide CAS Name: N-[(E)-1-(1-benzotriazolyl)propan-2-ylideneamino]-2-[(4-methylphenyl)thio]acetamide IUPAC Name: N-[(E)-1-(benzotriazol-1-yl)propan-2-ylideneamino]-2-(4-methylphenyl)sulfanylacetamide Traditional Name: N-[(E)-[2-(benzotriazol-1-yl)-1-methyl-ethylidene]amino]-2-(p-tolylthio)acetamide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NN=C(C)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N/N=C(\C)/CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H19N5OS/c1-13-7-9-15(10-8-13)25-12-18(24)21-19-14(2)11-23-17-6-4-3-5-16(17)20-22-23/h3-10H,11-12H2,1-2H3,(H,21,24)/b19-14+