3-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxo-ethyl]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-[4-(4-methoxy-2-pyrimidinyl)-1-piperazinyl]-2-oxoethyl]-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-oxoethyl]-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-[4-(4-methoxypyrimidin-2-yl)piperazino]ethyl]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H20N6O3S2 MolecularWeight: 468.5519

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CS5

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)CN3C=NC4=C(C3=O)C(=CS4)C5=CC=CS5

InChI

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