S-[4-methyl-2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[4-methyl-2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] 2,2-dimethylpropanethioate Openeye Name: S-[2-[(1-isopentylcyclohexanecarbonyl)amino]-4-methyl-phenyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[4-methyl-2-[[[1-(3-methylbutyl)cyclohexyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[4-methyl-2-[[1-(3-methylbutyl)cyclohexanecarbonyl]amino]phenyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[2-[(1-isoamylcyclohexanecarbonyl)amino]-4-methyl-phenyl] ester Formula: C24H37NO2S MolecularWeight: 403.62108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC(=O)C(C)(C)C)NC(=O)C2(CCCCC2)CCC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC(=O)C(C)(C)C)NC(=O)C2(CCCCC2)CCC(C)C

InChI

InChI=1S/C24H37NO2S/c1-17(2)12-15-24(13-8-7-9-14-24)21(26)25-19-16-18(3)10-11-20(19)28-22(27)23(4,5)6/h10-11,16-17H,7-9,12-15H2,1-6H3,(H,25,26)