N-(4-azanyl-2-methoxy-phenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-azanyl-2-methoxy-phenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-amino-2-methoxy-phenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-amino-2-methoxyphenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-amino-2-methoxyphenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-amino-2-methoxy-phenyl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N)NC(=O)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)N)NC(=O)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N5O2S/c1-24-14-9-12(18)7-8-13(14)19-15(23)10-25-17-20-16(21-22-17)11-5-3-2-4-6-11/h2-9H,10,18H2,1H3,(H,19,23)(H,20,21,22)