N-[4-[(5-phenylazanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]ethanamide

Systemtic Name: N-[4-[(5-phenylazanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]ethanamide Openeye Name: N-[4-[(5-anilino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]acetamide CAS Name: N-[4-[[(5-anilino-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]acetamide IUPAC Name: N-[4-[(5-anilino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]acetamide Traditional Name: N-[4-[[(5-anilino-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]acetamide Formula: C17H17N5OS MolecularWeight: 339.41478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CSC2=NNC(=N2)NC3=CC=CC=C3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CSC2=NNC(=N2)NC3=CC=CC=C3

InChI

InChI=1S/C17H17N5OS/c1-12(23)18-15-9-7-13(8-10-15)11-24-17-20-16(21-22-17)19-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,18,23)(H2,19,20,21,22)