[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]benzoic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2-[2-(dimethylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]benzoic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N(C)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N(C)C

InChI

InChI=1S/C21H24N2O4S/c1-15-8-4-5-9-16(15)12-22-19(24)13-27-21(26)17-10-6-7-11-18(17)28-14-20(25)23(2)3/h4-11H,12-14H2,1-3H3,(H,22,24)