N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4-cyanoanilino)-oxomethyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(4-cyanophenyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H14N6O2S MolecularWeight: 378.40776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H14N6O2S/c19-10-13-6-8-14(9-7-13)21-17(26)22-16(25)11-27-18-20-12-24(23-18)15-4-2-1-3-5-15/h1-9,12H,11H2,(H2,21,22,25,26)