6-methyl-5-(4-methylphenyl)-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-methyl-5-(4-methylphenyl)-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-methyl-N-piperidin-1-ium-4-yl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-methyl-5-(4-methylphenyl)-N-(4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-methyl-5-(4-methylphenyl)-N-piperidin-1-ium-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]-piperidin-1-ium-4-yl-amine Formula: C19H23N4S+ MolecularWeight: 339.47772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4CC[NH2+]CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=NC=NC(=C23)NC4CC[NH2+]CC4)C

InChI

InChI=1S/C19H22N4S/c1-12-3-5-14(6-4-12)16-13(2)24-19-17(16)18(21-11-22-19)23-15-7-9-20-10-8-15/h3-6,11,15,20H,7-10H2,1-2H3,(H,21,22,23)/p+1