3-(2-ethoxyethyl)-5-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(2-ethoxyethyl)-5-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2-ethoxyethyl)-5-methyl-6-[4-(2-pyridyl)piperazine-1-carbonyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2-ethoxyethyl)-5-methyl-6-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(2-ethoxyethyl)-5-methyl-6-(4-pyridin-2-ylpiperazine-1-carbonyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-ethoxyethyl)-5-methyl-6-[4-(2-pyridyl)piperazine-1-carbonyl]thieno[2,3-d]pyrimidin-4-one Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=N4)C

Isomeric SMILES

CCOCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)N3CCN(CC3)C4=CC=CC=N4)C

InChI

InChI=1S/C21H25N5O3S/c1-3-29-13-12-26-14-23-19-17(20(26)27)15(2)18(30-19)21(28)25-10-8-24(9-11-25)16-6-4-5-7-22-16/h4-7,14H,3,8-13H2,1-2H3