2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(6-methylpyridin-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(6-methylpyridin-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(6-methyl-2-pyridyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2,5-dimethyl-4-(4-methyl-1-piperazin-4-iumyl)-N-(6-methyl-2-pyridinyl)-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(6-methylpyridin-2-yl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2,5-dimethyl-4-(4-methylpiperazin-4-ium-1-yl)-N-(6-methyl-2-pyridyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H25N6OS+ MolecularWeight: 397.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C)N4CC[NH+](CC4)C)C

Isomeric SMILES

CC1=NC(=CC=C1)NC(=O)C2=C(C3=C(N=C(N=C3S2)C)N4CC[NH+](CC4)C)C

InChI

InChI=1S/C20H24N6OS/c1-12-6-5-7-15(21-12)24-19(27)17-13(2)16-18(22-14(3)23-20(16)28-17)26-10-8-25(4)9-11-26/h5-7H,8-11H2,1-4H3,(H,21,24,27)/p+1