(2R)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: (2R)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: (2R)-N-(benzylcarbamoyl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: (2R)-N-(benzylcarbamoyl)-2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(benzylcarbamoyl)-2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]propionamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C)C(=O)NC(=O)NCC2=CC=CC=C2)C3CCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)S[C@H](C)C(=O)NC(=O)NCC2=CC=CC=C2)C3CCCC3)C

InChI

InChI=1S/C21H28N4O2S/c1-14-15(2)25(18-11-7-8-12-18)21(23-14)28-16(3)19(26)24-20(27)22-13-17-9-5-4-6-10-17/h4-6,9-10,16,18H,7-8,11-13H2,1-3H3,(H2,22,24,26,27)/t16-/m1/s1