methyl 3-aminocarbonyl-4-(4-methoxyphenyl)sulfonyl-2-[methyl(pyridin-3-yl)amino]benzoate

Systemtic Name: methyl 3-aminocarbonyl-4-(4-methoxyphenyl)sulfonyl-2-[methyl(pyridin-3-yl)amino]benzoate Openeye Name: methyl 3-carbamoyl-4-(4-methoxyphenyl)sulfonyl-2-[methyl(3-pyridyl)amino]benzoate CAS Name: 3-carbamoyl-4-(4-methoxyphenyl)sulfonyl-2-[methyl(3-pyridinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-carbamoyl-4-(4-methoxyphenyl)sulfonyl-2-[methyl(pyridin-3-yl)amino]benzoate Traditional Name: 3-carbamoyl-4-(4-methoxyphenyl)sulfonyl-2-[methyl(3-pyridyl)amino]benzoic acid methyl ester Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CN=CC=C1)C2=C(C=CC(=C2C(=O)N)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CN(C1=CN=CC=C1)C2=C(C=CC(=C2C(=O)N)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C22H21N3O6S/c1-25(14-5-4-12-24-13-14)20-17(22(27)31-3)10-11-18(19(20)21(23)26)32(28,29)16-8-6-15(30-2)7-9-16/h4-13H,1-3H3,(H2,23,26)