(2R)-N-(4-ethanoylphenyl)-2-(1-methylimidazol-2-yl)sulfanyl-butanamide

Systemtic Name: (2R)-N-(4-ethanoylphenyl)-2-(1-methylimidazol-2-yl)sulfanyl-butanamide Openeye Name: (2R)-N-(4-acetylphenyl)-2-(1-methylimidazol-2-yl)sulfanyl-butanamide CAS Name: (2R)-N-(4-acetylphenyl)-2-[(1-methyl-2-imidazolyl)thio]butanamide IUPAC Name: (2R)-N-(4-acetylphenyl)-2-(1-methylimidazol-2-yl)sulfanylbutanamide Traditional Name: (2R)-N-(4-acetylphenyl)-2-[(1-methylimidazol-2-yl)thio]butyramide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC=CN2C

Isomeric SMILES

CC[C@H](C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NC=CN2C

InChI

InChI=1S/C16H19N3O2S/c1-4-14(22-16-17-9-10-19(16)3)15(21)18-13-7-5-12(6-8-13)11(2)20/h5-10,14H,4H2,1-3H3,(H,18,21)/t14-/m1/s1