2-[[4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylpiperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[4-(1-methyl-6-oxidanylidene-pyridazin-3-yl)carbonylpiperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[4-(1-methyl-6-oxo-pyridazine-3-carbonyl)piperazin-1-yl]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-[(1-methyl-6-oxo-3-pyridazinyl)-oxomethyl]-1-piperazinyl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[4-(1-methyl-6-oxopyridazine-3-carbonyl)piperazin-1-yl]methyl]-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-(6-keto-1-methyl-pyridazine-3-carbonyl)piperazino]methyl]-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H20N6O3S2 MolecularWeight: 468.5519

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)CC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

Isomeric SMILES

CN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)CC3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

InChI

InChI=1S/C21H20N6O3S2/c1-25-17(28)5-4-14(24-25)21(30)27-8-6-26(7-9-27)11-16-22-19(29)18-13(12-32-20(18)23-16)15-3-2-10-31-15/h2-5,10,12H,6-9,11H2,1H3,(H,22,23,29)