methyl 1-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-[[2-(4-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-[[2-keto-2-(p-toluidino)ethyl]thio]acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H26N2O4S MolecularWeight: 378.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2(CCCCC2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2(CCCCC2)C(=O)OC

InChI

InChI=1S/C19H26N2O4S/c1-14-6-8-15(9-7-14)20-16(22)12-26-13-17(23)21-19(18(24)25-2)10-4-3-5-11-19/h6-9H,3-5,10-13H2,1-2H3,(H,20,22)(H,21,23)