N-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(3-oxidanylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(7-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(3-oxidanylpropyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(3-hydroxypropyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-(3-hydroxypropyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(3-hydroxypropyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(3-hydroxypropyl)-N-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]piazthiole-4-sulfonamide Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)N2)CN(CCCO)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C20H20N4O4S2/c1-13-6-7-14-11-15(20(26)21-17(14)10-13)12-24(8-3-9-25)30(27,28)18-5-2-4-16-19(18)23-29-22-16/h2,4-7,10-11,25H,3,8-9,12H2,1H3,(H,21,26)