methyl 2-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(pyridin-3-ylmethyl)sulfamoyl]benzoate

Systemtic Name: methyl 2-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-(pyridin-3-ylmethyl)sulfamoyl]benzoate Openeye Name: methyl 2-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-pyridylmethyl)sulfamoyl]benzoate CAS Name: 2-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(3-pyridinylmethyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-(pyridin-3-ylmethyl)sulfamoyl]benzoate Traditional Name: 2-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl-(3-pyridylmethyl)sulfamoyl]benzoic acid methyl ester Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4C(=O)OC)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4C(=O)OC)C

InChI

InChI=1S/C26H25N3O5S/c1-17-11-20-13-21(25(30)28-23(20)12-18(17)2)16-29(15-19-7-6-10-27-14-19)35(32,33)24-9-5-4-8-22(24)26(31)34-3/h4-14H,15-16H2,1-3H3,(H,28,30)