[2-[cyclohexyl(ethyl)amino]-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-[cyclohexyl(ethyl)amino]-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate Openeye Name: [2-[cyclohexyl(ethyl)amino]-2-oxo-ethyl] 2-(2,5-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-[cyclohexyl(ethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexyl(ethyl)amino]-2-oxoethyl] 2-(2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-[cyclohexyl(ethyl)amino]-2-keto-ethyl] ester Formula: C20H29NO3S MolecularWeight: 363.51416

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)COC(=O)CSC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCN(C1CCCCC1)C(=O)COC(=O)CSC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H29NO3S/c1-4-21(17-8-6-5-7-9-17)19(22)13-24-20(23)14-25-18-12-15(2)10-11-16(18)3/h10-12,17H,4-9,13-14H2,1-3H3