S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] 2-(4-phenylphenyl)ethanethioate

Systemtic Name: S-[2-[(1-methylcyclohexyl)carbonylamino]phenyl] 2-(4-phenylphenyl)ethanethioate Openeye Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] 2-(4-phenylphenyl)ethanethioate CAS Name: 2-(4-phenylphenyl)ethanethioic acid S-[2-[[(1-methylcyclohexyl)-oxomethyl]amino]phenyl] ester IUPAC Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] 2-(4-phenylphenyl)ethanethioate Traditional Name: 2-(4-phenylphenyl)ethanethioic acid S-[2-[(1-methylcyclohexanecarbonyl)amino]phenyl] ester Formula: C28H29NO2S MolecularWeight: 443.60036

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1(CCCCC1)C(=O)NC2=CC=CC=C2SC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO2S/c1-28(18-8-3-9-19-28)27(31)29-24-12-6-7-13-25(24)32-26(30)20-21-14-16-23(17-15-21)22-10-4-2-5-11-22/h2,4-7,10-17H,3,8-9,18-20H2,1H3,(H,29,31)