[1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H27NO3S MolecularWeight: 349.48758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)NCC2CCCCC2

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)NCC2CCCCC2

InChI

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