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

Systemtic Name: N-[(phenylmethyl)carbamoyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(benzylcarbamoyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-[oxo-[(phenylmethyl)amino]methyl]-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(benzylcarbamoyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(benzylcarbamoyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H19N5O2S/c1-14(17(25)22-18(26)20-12-15-8-4-2-5-9-15)27-19-21-13-24(23-19)16-10-6-3-7-11-16/h2-11,13-14H,12H2,1H3,(H2,20,22,25,26)