(2R)-N-[(phenylmethyl)carbamoyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide

Systemtic Name: (2R)-N-[(phenylmethyl)carbamoyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Openeye Name: (2R)-N-(benzylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide CAS Name: (2R)-N-[oxo-[(phenylmethyl)amino]methyl]-2-(1H-1,2,4-triazol-5-ylthio)propanamide IUPAC Name: (2R)-N-(benzylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propanamide Traditional Name: (2R)-N-(benzylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylthio)propionamide Formula: C13H15N5O2S MolecularWeight: 305.3555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NC=NN2

Isomeric SMILES

C[C@H](C(=O)NC(=O)NCC1=CC=CC=C1)SC2=NC=NN2

InChI

InChI=1S/C13H15N5O2S/c1-9(21-13-15-8-16-18-13)11(19)17-12(20)14-7-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3,(H,15,16,18)(H2,14,17,19,20)/t9-/m1/s1