(2R)-1-cyclohexylcarbonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-[2-(phenylsulfonyl)ethanoyl]piperazine-2-carboxamide

Systemtic Name: (2R)-1-cyclohexylcarbonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-[2-(phenylsulfonyl)ethanoyl]piperazine-2-carboxamide Openeye Name: (2R)-4-[2-(benzenesulfonyl)acetyl]-1-(cyclohexanecarbonyl)-N-[(3S)-2-oxo-3-piperidyl]piperazine-2-carboxamide CAS Name: (2R)-4-[2-(benzenesulfonyl)-1-oxoethyl]-1-[cyclohexyl(oxo)methyl]-N-[(3S)-2-oxo-3-piperidinyl]-2-piperazinecarboxamide IUPAC Name: (2R)-4-[2-(benzenesulfonyl)acetyl]-1-(cyclohexanecarbonyl)-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide Traditional Name: (2R)-4-(2-besylacetyl)-1-(cyclohexanecarbonyl)-N-[(3S)-2-keto-3-piperidyl]piperazine-2-carboxamide Formula: C25H34N4O6S MolecularWeight: 518.62566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2CCN(CC2C(=O)NC3CCCNC3=O)C(=O)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C25H34N4O6S/c30-22(17-36(34,35)19-10-5-2-6-11-19)28-14-15-29(25(33)18-8-3-1-4-9-18)21(16-28)24(32)27-20-12-7-13-26-23(20)31/h2,5-6,10-11,18,20-21H,1,3-4,7-9,12-17H2,(H,26,31)(H,27,32)/t20-,21+/m0/s1