N-(1,3-benzodioxol-5-ylmethyl)-N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-N-piperonyl-piazthiole-4-sulfonamide Formula: C26H22N4O5S2 MolecularWeight: 534.60668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC6=NSN=C65)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC6=NSN=C65)C

InChI

InChI=1S/C26H22N4O5S2/c1-15-6-8-18-11-19(26(31)27-24(18)16(15)2)13-30(12-17-7-9-21-22(10-17)35-14-34-21)37(32,33)23-5-3-4-20-25(23)29-36-28-20/h3-11H,12-14H2,1-2H3,(H,27,31)