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

Systemtic Name: 3-ethyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-ethyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-ethyl-2-(1-piperazin-4-iumyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-ethyl-2-piperazin-4-ium-1-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-piperazin-4-ium-1-yl-thieno[2,3-d]pyrimidin-4-one Formula: C12H17N4OS+ MolecularWeight: 265.35458

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1N3CC[NH2+]CC3)SC=C2

Isomeric SMILES

CCN1C(=O)C2=C(N=C1N3CC[NH2+]CC3)SC=C2

InChI

InChI=1S/C12H16N4OS/c1-2-16-11(17)9-3-8-18-10(9)14-12(16)15-6-4-13-5-7-15/h3,8,13H,2,4-7H2,1H3/p+1