2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-6-ethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-6-ethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylthio]-6-ethyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-6-ethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-6-ethyl-2-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C22H22N4O4S2 MolecularWeight: 470.56448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

InChI

InChI=1S/C22H22N4O4S2/c1-5-7-26-21(28)14-8-12(6-2)32-20(14)25-22(26)31-11-18-23-15-10-17(30-4)16(29-3)9-13(15)19(27)24-18/h5,8-10H,1,6-7,11H2,2-4H3,(H,23,24,27)