5,6-dimethyl-N-(4-methylpiperazin-4-ium-1-yl)-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5,6-dimethyl-N-(4-methylpiperazin-4-ium-1-yl)-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5,6-dimethyl-N-(4-methylpiperazin-4-ium-1-yl)-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5,6-dimethyl-N-(4-methyl-1-piperazin-4-iumyl)-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5,6-dimethyl-N-(4-methylpiperazin-4-ium-1-yl)-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5,6-dimethyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)amine Formula: C18H23N6S+ MolecularWeight: 355.48042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NN3CC[NH+](CC3)C)C4=CN=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NN3CC[NH+](CC3)C)C4=CN=CC=C4)C

InChI

InChI=1S/C18H22N6S/c1-12-13(2)25-18-15(12)17(22-24-9-7-23(3)8-10-24)20-16(21-18)14-5-4-6-19-11-14/h4-6,11H,7-10H2,1-3H3,(H,20,21,22)/p+1