6-ethyl-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-ethyl-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-ethyl-2-[(4-methyl-1-piperazin-4-iumyl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-ethyl-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-ethyl-2-[(4-methylpiperazin-4-ium-1-yl)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C14H21N4OS+ MolecularWeight: 293.40774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(NC2=O)CN3CC[NH+](CC3)C

Isomeric SMILES

CCC1=CC2=C(S1)N=C(NC2=O)CN3CC[NH+](CC3)C

InChI

InChI=1S/C14H20N4OS/c1-3-10-8-11-13(19)15-12(16-14(11)20-10)9-18-6-4-17(2)5-7-18/h8H,3-7,9H2,1-2H3,(H,15,16,19)/p+1