(2R)-3-cyclopentyl-2-(4-methylsulfonylphenyl)-N-[5-(2-oxidanylidene-2-piperazin-1-yl-ethyl)sulfanyl-1,3-thiazol-2-yl]propanamide

Systemtic Name: (2R)-3-cyclopentyl-2-(4-methylsulfonylphenyl)-N-[5-(2-oxidanylidene-2-piperazin-1-yl-ethyl)sulfanyl-1,3-thiazol-2-yl]propanamide Openeye Name: (2R)-3-cyclopentyl-2-(4-methylsulfonylphenyl)-N-[5-(2-oxo-2-piperazin-1-yl-ethyl)sulfanylthiazol-2-yl]propanamide CAS Name: (2R)-3-cyclopentyl-2-(4-methylsulfonylphenyl)-N-[5-[[2-oxo-2-(1-piperazinyl)ethyl]thio]-2-thiazolyl]propanamide IUPAC Name: (2R)-3-cyclopentyl-2-(4-methylsulfonylphenyl)-N-[5-(2-oxo-2-piperazin-1-ylethyl)sulfanyl-1,3-thiazol-2-yl]propanamide Traditional Name: (2R)-3-cyclopentyl-N-[5-[(2-keto-2-piperazino-ethyl)thio]thiazol-2-yl]-2-(4-mesylphenyl)propionamide Formula: C24H32N4O4S3 MolecularWeight: 536.73028

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC=C(S3)SCC(=O)N4CCNCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)[C@@H](CC2CCCC2)C(=O)NC3=NC=C(S3)SCC(=O)N4CCNCC4

InChI

InChI=1S/C24H32N4O4S3/c1-35(31,32)19-8-6-18(7-9-19)20(14-17-4-2-3-5-17)23(30)27-24-26-15-22(34-24)33-16-21(29)28-12-10-25-11-13-28/h6-9,15,17,20,25H,2-5,10-14,16H2,1H3,(H,26,27,30)/t20-/m1/s1