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

Systemtic Name: (2S)-3-cyclohexyl-2-[4-(4-ethylphenyl)sulfonyl-2-oxidanylidene-piperazin-1-yl]-N-(1,3-thiazol-2-yl)propanamide Openeye Name: (2S)-3-cyclohexyl-2-[4-(4-ethylphenyl)sulfonyl-2-oxo-piperazin-1-yl]-N-thiazol-2-yl-propanamide CAS Name: (2S)-3-cyclohexyl-2-[4-(4-ethylphenyl)sulfonyl-2-oxo-1-piperazinyl]-N-(2-thiazolyl)propanamide IUPAC Name: (2S)-3-cyclohexyl-2-[4-(4-ethylphenyl)sulfonyl-2-oxopiperazin-1-yl]-N-(1,3-thiazol-2-yl)propanamide Traditional Name: (2S)-3-cyclohexyl-2-[4-(4-ethylphenyl)sulfonyl-2-keto-piperazino]-N-thiazol-2-yl-propionamide Formula: C24H32N4O4S2 MolecularWeight: 504.66528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(=O)C2)C(CC3CCCCC3)C(=O)NC4=NC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(C(=O)C2)[C@@H](CC3CCCCC3)C(=O)NC4=NC=CS4

InChI

InChI=1S/C24H32N4O4S2/c1-2-18-8-10-20(11-9-18)34(31,32)27-13-14-28(22(29)17-27)21(16-19-6-4-3-5-7-19)23(30)26-24-25-12-15-33-24/h8-12,15,19,21H,2-7,13-14,16-17H2,1H3,(H,25,26,30)/t21-/m0/s1