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

Systemtic Name: N-tert-butyl-N-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]quinoline-8-sulfonamide Openeye Name: N-tert-butyl-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]quinoline-8-sulfonamide CAS Name: N-tert-butyl-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-8-quinolinesulfonamide IUPAC Name: N-tert-butyl-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]quinoline-8-sulfonamide Traditional Name: N-tert-butyl-N-[2-keto-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]quinoline-8-sulfonamide Formula: C28H29N3O3S2 MolecularWeight: 519.67816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N3O3S2/c1-28(2,3)31(36(33,34)24-13-7-11-20-12-8-16-29-26(20)24)19-25(32)30-17-14-23-22(15-18-35-23)27(30)21-9-5-4-6-10-21/h4-13,15-16,18,27H,14,17,19H2,1-3H3