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

Systemtic Name: [1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclohexylamino)-1-oxopropan-2-yl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H25NO3S MolecularWeight: 335.461

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)NC2CCCCC2

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)NC2CCCCC2

InChI

InChI=1S/C18H25NO3S/c1-13-8-6-7-11-16(13)23-12-17(20)22-14(2)18(21)19-15-9-4-3-5-10-15/h6-8,11,14-15H,3-5,9-10,12H2,1-2H3,(H,19,21)