S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] benzenecarbothioate

Systemtic Name: S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] benzenecarbothioate Openeye Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[[(1-methylcyclohexyl)-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] ester Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO2S/c1-21(14-8-3-9-15-21)20(24)22-17-12-6-7-13-18(17)25-19(23)16-10-4-2-5-11-16/h2,4-7,10-13H,3,8-9,14-15H2,1H3,(H,22,24)