(2R)-N-(4-ethanoylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide

Systemtic Name: (2R)-N-(4-ethanoylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Openeye Name: (2R)-N-(4-acetylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide CAS Name: (2R)-N-(4-acetylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)butanamide IUPAC Name: (2R)-N-(4-acetylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)butanamide Traditional Name: (2R)-N-(4-acetylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)butyramide Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC=NN2

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC=NN2

InChI

InChI=1S/C14H16N4O2S/c1-3-12(21-14-15-8-16-18-14)13(20)17-11-6-4-10(5-7-11)9(2)19/h4-8,12H,3H2,1-2H3,(H,17,20)(H,15,16,18)/t12-/m1/s1