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

Systemtic Name: 5-cyclopropyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-cyclopropyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-cyclopropyl-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-cyclopropyl-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-cyclopropyl-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C26H23N3O2S2 MolecularWeight: 473.60972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N4CCC5=CC=CC=C5C4)C6=CC=CC=C6

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)N4CCC5=CC=CC=C5C4)C6=CC=CC=C6

InChI

InChI=1S/C26H23N3O2S2/c30-22(28-13-12-17-6-4-5-7-19(17)14-28)16-33-26-27-24-23(21(15-32-24)18-10-11-18)25(31)29(26)20-8-2-1-3-9-20/h1-9,15,18H,10-14,16H2