[2-[(3,4-dimethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-ethylsulfinylbenzoate

Systemtic Name: [2-[(3,4-dimethylphenyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-ethylsulfinylbenzoate Openeye Name: [2-[(3,4-dimethylphenyl)carbamoylamino]-2-oxo-ethyl] 2-ethylsulfinylbenzoate CAS Name: 2-ethylsulfinylbenzoic acid [2-[[(3,4-dimethylanilino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(3,4-dimethylphenyl)carbamoylamino]-2-oxoethyl] 2-ethylsulfinylbenzoate Traditional Name: 2-ethylsulfinylbenzoic acid [2-[(3,4-dimethylphenyl)carbamoylamino]-2-keto-ethyl] ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC=CC=C1C(=O)OCC(=O)NC(=O)NC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCS(=O)C1=CC=CC=C1C(=O)OCC(=O)NC(=O)NC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H22N2O5S/c1-4-28(26)17-8-6-5-7-16(17)19(24)27-12-18(23)22-20(25)21-15-10-9-13(2)14(3)11-15/h5-11H,4,12H2,1-3H3,(H2,21,22,23,25)