3-methyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-(1-piperazin-4-iumyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-piperazin-4-ium-1-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-methyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one Formula: C11H15N4OS+ MolecularWeight: 251.328

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1N3CC[NH2+]CC3)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1N3CC[NH2+]CC3)SC=C2

InChI

InChI=1S/C11H14N4OS/c1-14-10(16)8-2-7-17-9(8)13-11(14)15-5-3-12-4-6-15/h2,7,12H,3-6H2,1H3/p+1