(2R)-N-[(2S)-1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-1-cyclohexylcarbonyl-4-(3-fluorophenyl)carbonyl-piperazine-2-carboxamide

Systemtic Name: (2R)-N-[(2S)-1-azanyl-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-1-cyclohexylcarbonyl-4-(3-fluorophenyl)carbonyl-piperazine-2-carboxamide Openeye Name: (2R)-N-[(1S)-2-amino-1-(cyclohexylmethyl)-2-oxo-ethyl]-1-(cyclohexanecarbonyl)-4-(3-fluorobenzoyl)piperazine-2-carboxamide CAS Name: (2R)-N-[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]-1-[cyclohexyl(oxo)methyl]-4-[(3-fluorophenyl)-oxomethyl]-2-piperazinecarboxamide IUPAC Name: (2R)-N-[(2S)-1-amino-3-cyclohexyl-1-oxopropan-2-yl]-1-(cyclohexanecarbonyl)-4-(3-fluorobenzoyl)piperazine-2-carboxamide Traditional Name: (2R)-N-[(1S)-2-amino-1-(cyclohexylmethyl)-2-keto-ethyl]-1-(cyclohexanecarbonyl)-4-(3-fluorobenzoyl)piperazine-2-carboxamide Formula: C28H39FN4O4 MolecularWeight: 514.632063

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N)NC(=O)C2CN(CCN2C(=O)C3CCCCC3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)N)NC(=O)[C@H]2CN(CCN2C(=O)C3CCCCC3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C28H39FN4O4/c29-22-13-7-12-21(17-22)27(36)32-14-15-33(28(37)20-10-5-2-6-11-20)24(18-32)26(35)31-23(25(30)34)16-19-8-3-1-4-9-19/h7,12-13,17,19-20,23-24H,1-6,8-11,14-16,18H2,(H2,30,34)(H,31,35)/t23-,24+/m0/s1