[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(2,4-dimethylphenyl)sulfanylethanoate Openeye Name: [2-[(4-methylcyclohexyl)amino]-2-oxo-ethyl] 2-(2,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 2-(2,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [2-keto-2-[(4-methylcyclohexyl)amino]ethyl] ester Formula: C19H27NO3S MolecularWeight: 349.48758

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)COC(=O)CSC2=C(C=C(C=C2)C)C

Isomeric SMILES

CC1CCC(CC1)NC(=O)COC(=O)CSC2=C(C=C(C=C2)C)C

InChI

InChI=1S/C19H27NO3S/c1-13-4-7-16(8-5-13)20-18(21)11-23-19(22)12-24-17-9-6-14(2)10-15(17)3/h6,9-10,13,16H,4-5,7-8,11-12H2,1-3H3,(H,20,21)