(2R)-2-[[5-oxidanylidene-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-butanamide

Systemtic Name: (2R)-2-[[5-oxidanylidene-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-butanamide Openeye Name: (2R)-2-[(4-benzyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-butanamide CAS Name: (2R)-2-[[5-oxo-4-(phenylmethyl)-1H-1,2,4-triazol-3-yl]thio]-N-phenylbutanamide IUPAC Name: (2R)-2-[(4-benzyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]-N-phenylbutanamide Traditional Name: (2R)-2-[(4-benzyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-N-phenyl-butyramide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)SC2=NNC(=O)N2CC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=CC=C1)SC2=NNC(=O)N2CC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2S/c1-2-16(17(24)20-15-11-7-4-8-12-15)26-19-22-21-18(25)23(19)13-14-9-5-3-6-10-14/h3-12,16H,2,13H2,1H3,(H,20,24)(H,21,25)/t16-/m1/s1