2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-ethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-6-ethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]-6-ethyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl-6-ethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]-6-ethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC=C)SCC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O4S2/c1-5-9-23-20(25)15-11-14(6-2)29-19(15)22-21(23)28-12-16(24)13-7-8-17(26-3)18(10-13)27-4/h5,7-8,10-11H,1,6,9,12H2,2-4H3