S-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[2-[[1-(3-methylbutyl)cyclopentyl]carbonylamino]phenyl] 2,2-dimethylpropanethioate Openeye Name: S-[2-[(1-isopentylcyclopentanecarbonyl)amino]phenyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[2-[[[1-(3-methylbutyl)cyclopentyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[[1-(3-methylbutyl)cyclopentanecarbonyl]amino]phenyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[2-[(1-isoamylcyclopentanecarbonyl)amino]phenyl] ester Formula: C22H33NO2S MolecularWeight: 375.56792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33NO2S/c1-16(2)12-15-22(13-8-9-14-22)19(24)23-17-10-6-7-11-18(17)26-20(25)21(3,4)5/h6-7,10-11,16H,8-9,12-15H2,1-5H3,(H,23,24)