(2S)-2-[4-(4-cyanophenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]-3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide

Systemtic Name: (2S)-2-[4-(4-cyanophenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]-3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide Openeye Name: (2S)-2-[4-(4-cyanophenyl)sulfonyl-2-oxo-piperazin-1-yl]-3-cyclohexyl-N-thiazol-2-yl-propanamide CAS Name: (2S)-2-[4-(4-cyanophenyl)sulfonyl-2-oxo-1-piperazinyl]-3-cyclohexyl-N-(2-thiazolyl)propanamide IUPAC Name: (2S)-2-[4-(4-cyanophenyl)sulfonyl-2-oxopiperazin-1-yl]-3-cyclohexyl-N-(1,3-thiazol-2-yl)propanamide Traditional Name: (2S)-2-[4-(4-cyanophenyl)sulfonyl-2-keto-piperazino]-3-cyclohexyl-N-thiazol-2-yl-propionamide Formula: C23H27N5O4S2 MolecularWeight: 501.62158

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2=NC=CS2)N3CCN(CC3=O)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCC(CC1)C[C@@H](C(=O)NC2=NC=CS2)N3CCN(CC3=O)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H27N5O4S2/c24-15-18-6-8-19(9-7-18)34(31,32)27-11-12-28(21(29)16-27)20(14-17-4-2-1-3-5-17)22(30)26-23-25-10-13-33-23/h6-10,13,17,20H,1-5,11-12,14,16H2,(H,25,26,30)/t20-/m0/s1