2-[(E)-1-(4-bromophenyl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-en-2-yl]-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(E)-1-(4-bromophenyl)-3-morpholin-4-yl-3-oxidanylidene-prop-1-en-2-yl]-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(E)-2-(4-bromophenyl)-1-(morpholine-4-carbonyl)vinyl]-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(E)-1-(4-bromophenyl)-3-(4-morpholinyl)-3-oxoprop-1-en-2-yl]-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(E)-1-(4-bromophenyl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(E)-2-(4-bromophenyl)-1-(morpholine-4-carbonyl)vinyl]-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)NC(=N2)C(=CC3=CC=C(C=C3)Br)C(=O)N4CCOCC4)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)NC(=N2)/C(=C\C3=CC=C(C=C3)Br)/C(=O)N4CCOCC4)C

InChI

InChI=1S/C22H22BrN3O3S/c1-3-16-13(2)30-21-18(16)20(27)24-19(25-21)17(12-14-4-6-15(23)7-5-14)22(28)26-8-10-29-11-9-26/h4-7,12H,3,8-11H2,1-2H3,(H,24,25,27)/b17-12+