2-methyl-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide

Systemtic Name: 2-methyl-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)quinoline-8-sulfonamide Openeye Name: 2-methyl-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoline-8-sulfonamide CAS Name: 2-methyl-N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-8-quinolinesulfonamide IUPAC Name: 2-methyl-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoline-8-sulfonamide Traditional Name: 2-methyl-N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]quinoline-8-sulfonamide Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NC3=CC4=C(CCN(C4)C(=O)C5=CC=CS5)C=C3)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NC3=CC4=C(CCN(C4)C(=O)C5=CC=CS5)C=C3)C=C1

InChI

InChI=1S/C24H21N3O3S2/c1-16-7-8-18-4-2-6-22(23(18)25-16)32(29,30)26-20-10-9-17-11-12-27(15-19(17)14-20)24(28)21-5-3-13-31-21/h2-10,13-14,26H,11-12,15H2,1H3