S-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl] 4-tert-butylcyclohexane-1-carbothioate

Systemtic Name: S-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl] 4-tert-butylcyclohexane-1-carbothioate Openeye Name: S-[2-[(1-isopentylcyclopentanecarbonyl)amino]phenyl] 4-tert-butylcyclohexanecarbothioate CAS Name: 4-tert-butyl-1-cyclohexanecarbothioic acid S-[2-[[[1-(3-methylbutyl)cyclopentyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[[1-(3-methylbutyl)cyclopentanecarbonyl]amino]phenyl] 4-tert-butylcyclohexane-1-carbothioate Traditional Name: 4-tert-butylcyclohexanecarbothioic acid S-[2-[(1-isoamylcyclopentanecarbonyl)amino]phenyl] ester Formula: C28H43NO2S MolecularWeight: 457.71152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCC1)C(=O)NC2=CC=CC=C2SC(=O)C3CCC(CC3)C(C)(C)C

Isomeric SMILES

CC(C)CCC1(CCCC1)C(=O)NC2=CC=CC=C2SC(=O)C3CCC(CC3)C(C)(C)C

InChI

InChI=1S/C28H43NO2S/c1-20(2)16-19-28(17-8-9-18-28)26(31)29-23-10-6-7-11-24(23)32-25(30)21-12-14-22(15-13-21)27(3,4)5/h6-7,10-11,20-22H,8-9,12-19H2,1-5H3,(H,29,31)