5-methyl-3-(2-piperazin-4-ium-1-ylethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-methyl-3-(2-piperazin-4-ium-1-ylethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-methyl-3-(2-piperazin-4-ium-1-ylethyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-methyl-3-[2-(1-piperazin-4-iumyl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-methyl-3-(2-piperazin-4-ium-1-ylethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-methyl-3-(2-piperazin-4-ium-1-ylethyl)thieno[2,3-d]pyrimidin-4-one Formula: C13H19N4OS+ MolecularWeight: 279.38116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C(=O)N(C=N2)CCN3CC[NH2+]CC3

Isomeric SMILES

CC1=CSC2=C1C(=O)N(C=N2)CCN3CC[NH2+]CC3

InChI

InChI=1S/C13H18N4OS/c1-10-8-19-12-11(10)13(18)17(9-15-12)7-6-16-4-2-14-3-5-16/h8-9,14H,2-7H2,1H3/p+1