(2R)-4-(4-cyanophenyl)carbonyl-N1-cyclohexyl-N2-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-1,2-dicarboxamide

Systemtic Name: (2R)-4-(4-cyanophenyl)carbonyl-N1-cyclohexyl-N2-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-1,2-dicarboxamide Openeye Name: (2R)-4-(4-cyanobenzoyl)-N1-cyclohexyl-N2-[(3S)-2-oxo-3-piperidyl]piperazine-1,2-dicarboxamide CAS Name: (2R)-4-[(4-cyanophenyl)-oxomethyl]-N1-cyclohexyl-N2-[(3S)-2-oxo-3-piperidinyl]piperazine-1,2-dicarboxamide IUPAC Name: (2R)-4-(4-cyanobenzoyl)-1-N-cyclohexyl-2-N-[(3S)-2-oxopiperidin-3-yl]piperazine-1,2-dicarboxamide Traditional Name: (2R)-4-(4-cyanobenzoyl)-N-cyclohexyl-N'-[(3S)-2-keto-3-piperidyl]piperazine-1,2-dicarboxamide Formula: C25H32N6O4 MolecularWeight: 480.55938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCN(CC2C(=O)NC3CCCNC3=O)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCN(C[C@@H]2C(=O)N[C@H]3CCCNC3=O)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H32N6O4/c26-15-17-8-10-18(11-9-17)24(34)30-13-14-31(25(35)28-19-5-2-1-3-6-19)21(16-30)23(33)29-20-7-4-12-27-22(20)32/h8-11,19-21H,1-7,12-14,16H2,(H,27,32)(H,28,35)(H,29,33)/t20-,21+/m0/s1