3-azanyl-N-(4-bromophenyl)-6-pyridin-1-ium-4-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(4-bromophenyl)-6-pyridin-1-ium-4-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(4-bromophenyl)-6-pyridin-1-ium-4-yl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(4-bromophenyl)-6-(4-pyridin-1-iumyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(4-bromophenyl)-6-pyridin-1-ium-4-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(4-bromophenyl)-6-pyridin-1-ium-4-yl-thieno[2,3-b]pyridine-2-carboxamide Formula: C19H14BrN4OS+ MolecularWeight: 426.30966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=[NH+]C=C4)N)Br

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=[NH+]C=C4)N)Br

InChI

InChI=1S/C19H13BrN4OS/c20-12-1-3-13(4-2-12)23-18(25)17-16(21)14-5-6-15(24-19(14)26-17)11-7-9-22-10-8-11/h1-10H,21H2,(H,23,25)/p+1