2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-3-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-3-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-5,6-dimethyl-3-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-5,6-dimethyl-3-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-5,6-dimethyl-3-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one Traditional Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-5,6-dimethyl-3-phenyl-4aH-thieno[2,3-d]pyrimidin-3-ium-4-one Formula: C25H24N3O2S2+ MolecularWeight: 462.60696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=[N+](C(=O)C12)C3=CC=CC=C3)SCC(=O)N4CCCC5=CC=CC=C54)C

Isomeric SMILES

CC1=C(SC2=NC(=[N+](C(=O)C12)C3=CC=CC=C3)SCC(=O)N4CCCC5=CC=CC=C54)C

InChI

InChI=1S/C25H24N3O2S2/c1-16-17(2)32-23-22(16)24(30)28(19-11-4-3-5-12-19)25(26-23)31-15-21(29)27-14-8-10-18-9-6-7-13-20(18)27/h3-7,9,11-13,22H,8,10,14-15H2,1-2H3/q+1