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

Systemtic Name: S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] nonanethioate Openeye Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] nonanethioate CAS Name: nonanethioic acid S-[2-[[(1-methylcyclohexyl)-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] nonanethioate Traditional Name: nonanethioic acid S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] ester Formula: C23H35NO2S MolecularWeight: 389.5945

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)SC1=CC=CC=C1NC(=O)C2(CCCCC2)C

Isomeric SMILES

CCCCCCCCC(=O)SC1=CC=CC=C1NC(=O)C2(CCCCC2)C

InChI

InChI=1S/C23H35NO2S/c1-3-4-5-6-7-9-16-21(25)27-20-15-11-10-14-19(20)24-22(26)23(2)17-12-8-13-18-23/h10-11,14-15H,3-9,12-13,16-18H2,1-2H3,(H,24,26)