[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)sulfanylethanoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 2-(2,5-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2-(2,5-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,5-dimethylphenyl)thio]acetic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)OCC(=O)NCC2=CC=CC=C2C

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)OCC(=O)NCC2=CC=CC=C2C

InChI

InChI=1S/C20H23NO3S/c1-14-8-9-16(3)18(10-14)25-13-20(23)24-12-19(22)21-11-17-7-5-4-6-15(17)2/h4-10H,11-13H2,1-3H3,(H,21,22)