2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 1-allyl-2-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]sulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-2-oxoethyl]thio]-1-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]sulfanyl-1-prop-2-enyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 1-allyl-2-[[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]thio]-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C23H24N2O4S2 MolecularWeight: 456.57766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NC(=O)C3=C(N2CC=C)SC4=C3CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NC(=O)C3=C(N2CC=C)SC4=C3CCCC4)OC

InChI

InChI=1S/C23H24N2O4S2/c1-4-11-25-22-20(15-7-5-6-8-19(15)31-22)21(27)24-23(25)30-13-16(26)14-9-10-17(28-2)18(12-14)29-3/h4,9-10,12H,1,5-8,11,13H2,2-3H3