methyl 4-methyl-3-[2-(2-methylphenyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(2-methylphenyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-(o-tolylsulfanyl)acetyl]amino]benzoate CAS Name: 4-methyl-3-[[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(2-methylphenyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-(o-tolylthio)acetyl]amino]benzoic acid methyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=CC=CC=C2C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSC2=CC=CC=C2C

InChI

InChI=1S/C18H19NO3S/c1-12-8-9-14(18(21)22-3)10-15(12)19-17(20)11-23-16-7-5-4-6-13(16)2/h4-10H,11H2,1-3H3,(H,19,20)