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

Systemtic Name: N-butyl-N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]quinoline-8-sulfonamide Openeye Name: N-butyl-N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]quinoline-8-sulfonamide CAS Name: N-butyl-N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-8-quinolinesulfonamide IUPAC Name: N-butyl-N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]quinoline-8-sulfonamide Traditional Name: N-butyl-N-[2-[4-(2,4-dichlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-keto-ethyl]quinoline-8-sulfonamide Formula: C28H27Cl2N3O3S2 MolecularWeight: 588.56828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N1CCC2=C(C1C3=C(C=C(C=C3)Cl)Cl)C=CS2)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCCCN(CC(=O)N1CCC2=C(C1C3=C(C=C(C=C3)Cl)Cl)C=CS2)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C28H27Cl2N3O3S2/c1-2-3-14-32(38(35,36)25-8-4-6-19-7-5-13-31-27(19)25)18-26(34)33-15-11-24-22(12-16-37-24)28(33)21-10-9-20(29)17-23(21)30/h4-10,12-13,16-17,28H,2-3,11,14-15,18H2,1H3