2-[5-(3,4-dimethoxyphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[3-allyl-5-(3,4-dimethoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[5-(3,4-dimethoxyphenyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]thio]-N-phenylacetamide IUPAC Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[3-allyl-5-(3,4-dimethoxyphenyl)-4-keto-thieno[2,3-d]pyrimidin-2-yl]thio]-N-phenyl-acetamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4)CC=C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4)CC=C)OC

InChI

InChI=1S/C25H23N3O4S2/c1-4-12-28-24(30)22-18(16-10-11-19(31-2)20(13-16)32-3)14-33-23(22)27-25(28)34-15-21(29)26-17-8-6-5-7-9-17/h4-11,13-14H,1,12,15H2,2-3H3,(H,26,29)