N-[(1S,2R)-2-[[(1S)-1-cyano-3-methyl-butyl]carbamoyl]cyclohexyl]-4-imidazol-1-yl-benzamide

Systemtic Name: N-[(1S,2R)-2-[[(1S)-1-cyano-3-methyl-butyl]carbamoyl]cyclohexyl]-4-imidazol-1-yl-benzamide Openeye Name: N-[(1S,2R)-2-[[(1S)-1-cyano-3-methyl-butyl]carbamoyl]cyclohexyl]-4-imidazol-1-yl-benzamide CAS Name: N-[(1S,2R)-2-[[[(1S)-1-cyano-3-methylbutyl]amino]-oxomethyl]cyclohexyl]-4-(1-imidazolyl)benzamide IUPAC Name: N-[(1S,2R)-2-[[(1S)-1-cyano-3-methylbutyl]carbamoyl]cyclohexyl]-4-imidazol-1-ylbenzamide Traditional Name: N-[(1S,2R)-2-[[(1S)-1-cyano-3-methyl-butyl]carbamoyl]cyclohexyl]-4-imidazol-1-yl-benzamide Formula: C23H29N5O2 MolecularWeight: 407.50866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C#N)NC(=O)C1CCCCC1NC(=O)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC(C)C[C@@H](C#N)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C23H29N5O2/c1-16(2)13-18(14-24)26-23(30)20-5-3-4-6-21(20)27-22(29)17-7-9-19(10-8-17)28-12-11-25-15-28/h7-12,15-16,18,20-21H,3-6,13H2,1-2H3,(H,26,30)(H,27,29)/t18-,20+,21-/m0/s1