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

Systemtic Name: 5-(4-methoxyphenyl)-6-methyl-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-methoxyphenyl)-6-methyl-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-methoxyphenyl)-6-methyl-N-(4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-methoxyphenyl)-6-methyl-N-piperidin-1-ium-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-methoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]-piperidin-1-ium-4-yl-amine Formula: C19H23N4OS+ MolecularWeight: 355.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC3CC[NH2+]CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC3CC[NH2+]CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C19H22N4OS/c1-12-16(13-3-5-15(24-2)6-4-13)17-18(21-11-22-19(17)25-12)23-14-7-9-20-10-8-14/h3-6,11,14,20H,7-10H2,1-2H3,(H,21,22,23)/p+1