propan-2-yl 3-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoylamino]benzoate

Systemtic Name: propan-2-yl 3-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfonylethanoylamino]benzoate Openeye Name: isopropyl 3-[[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfonylacetyl]amino]benzoate CAS Name: 3-[[2-[2-(3-methylanilino)-2-oxoethyl]sulfonyl-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-[2-(3-methylanilino)-2-oxoethyl]sulfonylacetyl]amino]benzoate Traditional Name: 3-[[2-[2-keto-2-(m-toluidino)ethyl]sulfonylacetyl]amino]benzoic acid isopropyl ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CS(=O)(=O)CC(=O)NC2=CC=CC(=C2)C(=O)OC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CS(=O)(=O)CC(=O)NC2=CC=CC(=C2)C(=O)OC(C)C

InChI

InChI=1S/C21H24N2O6S/c1-14(2)29-21(26)16-7-5-9-18(11-16)23-20(25)13-30(27,28)12-19(24)22-17-8-4-6-15(3)10-17/h4-11,14H,12-13H2,1-3H3,(H,22,24)(H,23,25)