N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)quinoline-8-sulfonamide

Systemtic Name: N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)quinoline-8-sulfonamide Openeye Name: N-isobutyl-N-[2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]quinoline-8-sulfonamide CAS Name: N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)-8-quinolinesulfonamide IUPAC Name: N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(2-methylpropyl)quinoline-8-sulfonamide Traditional Name: N-isobutyl-N-[2-keto-2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]quinoline-8-sulfonamide Formula: C29H31N3O3S2 MolecularWeight: 533.70474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CC(C)C)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)SC=C3

Isomeric SMILES

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CC(C)C)S(=O)(=O)C4=CC=CC5=C4N=CC=C5)SC=C3

InChI

InChI=1S/C29H31N3O3S2/c1-20(2)18-31(37(34,35)26-12-6-9-22-10-7-15-30-28(22)26)19-27(33)32-16-13-25-24(14-17-36-25)29(32)23-11-5-4-8-21(23)3/h4-12,14-15,17,20,29H,13,16,18-19H2,1-3H3