N-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(6-ethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(o-tolyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(6-ethoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-[2-(2-methylphenyl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(6-ethoxy-2-keto-1H-quinolin-3-yl)methyl]-N-[2-(o-tolyl)ethyl]piazthiole-4-sulfonamide Formula: C27H26N4O4S2 MolecularWeight: 534.64974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC3=CC=CC=C3C)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CCC3=CC=CC=C3C)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C27H26N4O4S2/c1-3-35-22-11-12-23-20(16-22)15-21(27(32)28-23)17-31(14-13-19-8-5-4-7-18(19)2)37(33,34)25-10-6-9-24-26(25)30-36-29-24/h4-12,15-16H,3,13-14,17H2,1-2H3,(H,28,32)