N-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-pyridylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-pyridinylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(pyridin-3-ylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[(2-keto-6,7-dimethyl-1H-quinolin-3-yl)methyl]-N-(3-pyridylmethyl)piazthiole-4-sulfonamide Formula: C24H21N5O3S2 MolecularWeight: 491.58524

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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=CC5=NSN=C54)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(CC3=CN=CC=C3)S(=O)(=O)C4=CC=CC5=NSN=C54)C

InChI

InChI=1S/C24H21N5O3S2/c1-15-9-18-11-19(24(30)26-21(18)10-16(15)2)14-29(13-17-5-4-8-25-12-17)34(31,32)22-7-3-6-20-23(22)28-33-27-20/h3-12H,13-14H2,1-2H3,(H,26,30)