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

Systemtic Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-3-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-6-ethyl-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-6-ethyl-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-6-ethyl-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-6-ethyl-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)C)SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)C)SCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H21N3O2S2/c1-3-15-10-16-18(27-15)21-20(22(2)19(16)25)26-12-17(24)23-9-8-13-6-4-5-7-14(13)11-23/h4-7,10H,3,8-9,11-12H2,1-2H3