5-(4-bromophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-bromophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-bromophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-bromophenyl)-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-bromophenyl)-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]-methyl-(1-methylpiperidin-1-ium-4-yl)amine Formula: C19H22BrN4S+ MolecularWeight: 418.37378

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)Br

InChI

InChI=1S/C19H21BrN4S/c1-23-9-7-15(8-10-23)24(2)18-17-16(11-25-19(17)22-12-21-18)13-3-5-14(20)6-4-13/h3-6,11-12,15H,7-10H2,1-2H3/p+1