S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] 1-methylcyclohexane-1-carbothioate

Systemtic Name: S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] 1-methylcyclohexane-1-carbothioate Openeye Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] 1-methylcyclohexanecarbothioate CAS Name: 1-methyl-1-cyclohexanecarbothioic acid S-[2-[[(1-methylcyclohexyl)-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] 1-methylcyclohexane-1-carbothioate Traditional Name: 1-methylcyclohexanecarbothioic acid S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] ester Formula: C22H31NO2S MolecularWeight: 373.55204

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)C3(CCCCC3)C

Isomeric SMILES

CC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)C3(CCCCC3)C

InChI

InChI=1S/C22H31NO2S/c1-21(13-7-3-8-14-21)19(24)23-17-11-5-6-12-18(17)26-20(25)22(2)15-9-4-10-16-22/h5-6,11-12H,3-4,7-10,13-16H2,1-2H3,(H,23,24)