[4-[(2S)-2-[[(4R)-2,2-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidin-4-yl]carbonylamino]-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]phenyl] 4-methylpiperazine-1-carboxylate

Systemtic Name: [4-[(2S)-2-[[(4R)-2,2-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidin-4-yl]carbonylamino]-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]phenyl] 4-methylpiperazine-1-carboxylate Openeye Name: [4-[(2S)-3-tert-butoxy-2-[[(4R)-2,2-dimethyl-3-(p-tolylsulfonyl)thiazolidine-4-carbonyl]amino]-3-oxo-propyl]phenyl] 4-methylpiperazine-1-carboxylate CAS Name: 4-methyl-1-piperazinecarboxylic acid [4-[(2S)-2-[[[(4R)-2,2-dimethyl-3-(4-methylphenyl)sulfonyl-4-thiazolidinyl]-oxomethyl]amino]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenyl] ester IUPAC Name: [4-[(2S)-2-[[(4R)-2,2-dimethyl-3-(4-methylphenyl)sulfonyl-1,3-thiazolidine-4-carbonyl]amino]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]phenyl] 4-methylpiperazine-1-carboxylate Traditional Name: 4-methylpiperazine-1-carboxylic acid [4-[(2S)-3-tert-butoxy-2-[[(4R)-2,2-dimethyl-3-tosyl-thiazolidine-4-carbonyl]amino]-3-keto-propyl]phenyl] ester Formula: C32H44N4O7S2 MolecularWeight: 660.84436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CSC2(C)C)C(=O)NC(CC3=CC=C(C=C3)OC(=O)N4CCN(CC4)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CSC2(C)C)C(=O)N[C@@H](CC3=CC=C(C=C3)OC(=O)N4CCN(CC4)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H44N4O7S2/c1-22-8-14-25(15-9-22)45(40,41)36-27(21-44-32(36,5)6)28(37)33-26(29(38)43-31(2,3)4)20-23-10-12-24(13-11-23)42-30(39)35-18-16-34(7)17-19-35/h8-15,26-27H,16-21H2,1-7H3,(H,33,37)/t26-,27-/m0/s1