5-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: 3-morpholin-4-ium-4-ylpropyl-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C20H24N4OS/c1-15-3-5-16(6-4-15)17-13-26-20-18(17)19(22-14-23-20)21-7-2-8-24-9-11-25-12-10-24/h3-6,13-14H,2,7-12H2,1H3,(H,21,22,23)/p+1