N-(2-phenylsulfanylphenyl)-3-(1,2,4-triazol-1-yl)propanamide

Systemtic Name: N-(2-phenylsulfanylphenyl)-3-(1,2,4-triazol-1-yl)propanamide Openeye Name: N-(2-phenylsulfanylphenyl)-3-(1,2,4-triazol-1-yl)propanamide CAS Name: N-[2-(phenylthio)phenyl]-3-(1,2,4-triazol-1-yl)propanamide IUPAC Name: N-(2-phenylsulfanylphenyl)-3-(1,2,4-triazol-1-yl)propanamide Traditional Name: N-[2-(phenylthio)phenyl]-3-(1,2,4-triazol-1-yl)propionamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CCN3C=NC=N3

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC(=O)CCN3C=NC=N3

InChI

InChI=1S/C17H16N4OS/c22-17(10-11-21-13-18-12-19-21)20-15-8-4-5-9-16(15)23-14-6-2-1-3-7-14/h1-9,12-13H,10-11H2,(H,20,22)