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

Systemtic Name: 5-(3,4-dimethoxyphenyl)-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(3,4-dimethoxyphenyl)-N-piperidin-1-ium-4-yl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(3,4-dimethoxyphenyl)-N-(4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(3,4-dimethoxyphenyl)-N-piperidin-1-ium-4-ylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(3,4-dimethoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]-piperidin-1-ium-4-yl-amine Formula: C19H23N4O2S+ MolecularWeight: 371.47652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)NC4CC[NH2+]CC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)NC4CC[NH2+]CC4)OC

InChI

InChI=1S/C19H22N4O2S/c1-24-15-4-3-12(9-16(15)25-2)14-10-26-19-17(14)18(21-11-22-19)23-13-5-7-20-8-6-13/h3-4,9-11,13,20H,5-8H2,1-2H3,(H,21,22,23)/p+1