2-[(E)-1-(4-ethoxyphenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-en-2-yl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(E)-1-(4-ethoxyphenyl)-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-en-2-yl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(E)-2-(4-ethoxyphenyl)-1-(pyrrolidine-1-carbonyl)vinyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(E)-1-(4-ethoxyphenyl)-3-oxo-3-(1-pyrrolidinyl)prop-1-en-2-yl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(E)-1-(4-ethoxyphenyl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5,6-dimethyl-2-[(E)-2-p-phenetyl-1-(pyrrolidine-1-carbonyl)vinyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H25N3O3S MolecularWeight: 423.5279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(C2=NC3=C(C(=C(S3)C)C)C(=O)N2)C(=O)N4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(\C2=NC3=C(C(=C(S3)C)C)C(=O)N2)/C(=O)N4CCCC4

InChI

InChI=1S/C23H25N3O3S/c1-4-29-17-9-7-16(8-10-17)13-18(23(28)26-11-5-6-12-26)20-24-21(27)19-14(2)15(3)30-22(19)25-20/h7-10,13H,4-6,11-12H2,1-3H3,(H,24,25,27)/b18-13+