3-cyclopentyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-cyclopentyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-cyclopentyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-cyclopentyl-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-cyclopentyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-cyclopentyl-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCC4=CC=CC=C4C3)C5CCCC5)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)N3CCC4=CC=CC=C4C3)C5CCCC5)C

InChI

InChI=1S/C24H27N3O2S2/c1-15-16(2)31-22-21(15)23(29)27(19-9-5-6-10-19)24(25-22)30-14-20(28)26-12-11-17-7-3-4-8-18(17)13-26/h3-4,7-8,19H,5-6,9-14H2,1-2H3