N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-(oxolan-2-ylmethyl)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-(oxolan-2-ylmethyl)quinoline-8-sulfonamide Openeye Name: N-[2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-N-(tetrahydrofuran-2-ylmethyl)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-oxolanylmethyl)-8-quinolinesulfonamide IUPAC Name: N-[2-[4-(2-methylphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(oxolan-2-ylmethyl)quinoline-8-sulfonamide Traditional Name: N-[2-keto-2-[4-(o-tolyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethyl]-N-(tetrahydrofurfuryl)quinoline-8-sulfonamide Formula: C30H31N3O4S2 MolecularWeight: 561.71484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CC4CCCO4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6)SC=C3

Isomeric SMILES

CC1=CC=CC=C1C2C3=C(CCN2C(=O)CN(CC4CCCO4)S(=O)(=O)C5=CC=CC6=C5N=CC=C6)SC=C3

InChI

InChI=1S/C30H31N3O4S2/c1-21-7-2-3-11-24(21)30-25-14-18-38-26(25)13-16-33(30)28(34)20-32(19-23-10-6-17-37-23)39(35,36)27-12-4-8-22-9-5-15-31-29(22)27/h2-5,7-9,11-12,14-15,18,23,30H,6,10,13,16-17,19-20H2,1H3