methyl 3-[[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 3-[[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanylmethyl]benzoate Traditional Name: 3-[[[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]thio]methyl]benzoic acid methyl ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSCC2=CC=CC(=C2)C(=O)OC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSCC2=CC=CC(=C2)C(=O)OC)C

InChI

InChI=1S/C20H23NO3S/c1-4-16-9-5-7-14(2)19(16)21-18(22)13-25-12-15-8-6-10-17(11-15)20(23)24-3/h5-11H,4,12-13H2,1-3H3,(H,21,22)