S-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] N-tert-butylcarbamothioate

Systemtic Name: S-[2-[[1-(3-methylbutyl)cyclohexyl]carbonylamino]phenyl] N-tert-butylcarbamothioate Openeye Name: S-[2-[(1-isopentylcyclohexanecarbonyl)amino]phenyl] N-tert-butylcarbamothioate CAS Name: N-tert-butylcarbamothioic acid S-[2-[[[1-(3-methylbutyl)cyclohexyl]-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[[1-(3-methylbutyl)cyclohexanecarbonyl]amino]phenyl] N-tert-butylcarbamothioate Traditional Name: N-tert-butylthiocarbamic acid S-[2-[(1-isoamylcyclohexanecarbonyl)amino]phenyl] ester Formula: C23H36N2O2S MolecularWeight: 404.60914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)NC(C)(C)C

Isomeric SMILES

CC(C)CCC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)NC(C)(C)C

InChI

InChI=1S/C23H36N2O2S/c1-17(2)13-16-23(14-9-6-10-15-23)20(26)24-18-11-7-8-12-19(18)28-21(27)25-22(3,4)5/h7-8,11-12,17H,6,9-10,13-16H2,1-5H3,(H,24,26)(H,25,27)