5-(3,4-dimethoxyphenyl)-3-(2-oxidanylidenepropyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-(2-oxidanylidenepropyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-acetonyl-5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3,4-dimethoxyphenyl)-3-(2-oxopropyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(3,4-dimethoxyphenyl)-3-(2-oxopropyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-acetonyl-5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-one Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C17H16N2O4S/c1-10(20)7-19-9-18-16-15(17(19)21)12(8-24-16)11-4-5-13(22-2)14(6-11)23-3/h4-6,8-9H,7H2,1-3H3