(2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-[(2R)-4-phenylbutan-2-yl]propanamide

Systemtic Name: (2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-[(2R)-4-phenylbutan-2-yl]propanamide Openeye Name: (2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-[(1R)-1-methyl-3-phenyl-propyl]propanamide CAS Name: (2S)-2-[(1-methyl-2-imidazolyl)thio]-N-[(2R)-4-phenylbutan-2-yl]propanamide IUPAC Name: (2S)-2-(1-methylimidazol-2-yl)sulfanyl-N-[(2R)-4-phenylbutan-2-yl]propanamide Traditional Name: (2S)-2-[(1-methylimidazol-2-yl)thio]-N-[(1R)-1-methyl-3-phenyl-propyl]propionamide Formula: C17H23N3OS MolecularWeight: 317.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C(C)SC2=NC=CN2C

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)[C@H](C)SC2=NC=CN2C

InChI

InChI=1S/C17H23N3OS/c1-13(9-10-15-7-5-4-6-8-15)19-16(21)14(2)22-17-18-11-12-20(17)3/h4-8,11-14H,9-10H2,1-3H3,(H,19,21)/t13-,14+/m1/s1