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

Systemtic Name: methyl 1-[2-(4-methylphenyl)sulfanylethanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(p-tolylsulfanyl)acetyl]amino]cyclohexanecarboxylate CAS Name: 1-[[2-[(4-methylphenyl)thio]-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-methylphenyl)sulfanylacetyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[2-(p-tolylthio)acetyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2(CCCCC2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2(CCCCC2)C(=O)OC

InChI

InChI=1S/C17H23NO3S/c1-13-6-8-14(9-7-13)22-12-15(19)18-17(16(20)21-2)10-4-3-5-11-17/h6-9H,3-5,10-12H2,1-2H3,(H,18,19)