(2R)-N-(4-ethanoylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide

Systemtic Name: (2R)-N-(4-ethanoylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Openeye Name: (2R)-N-(4-acetylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide CAS Name: (2R)-N-(4-acetylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]butanamide IUPAC Name: (2R)-N-(4-acetylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanamide Traditional Name: (2R)-N-(4-acetylphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]butyramide Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NNC(=N2)C

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NNC(=N2)C

InChI

InChI=1S/C15H18N4O2S/c1-4-13(22-15-16-10(3)18-19-15)14(21)17-12-7-5-11(6-8-12)9(2)20/h5-8,13H,4H2,1-3H3,(H,17,21)(H,16,18,19)/t13-/m1/s1