4-azanyl-3-bromanyl-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile

Systemtic Name: 4-azanyl-3-bromanyl-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile Openeye Name: 4-amino-3-bromo-5-(2-chlorophenyl)-7-(3-pyridylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile CAS Name: 4-amino-3-bromo-5-(2-chlorophenyl)-7-(3-pyridinylmethylamino)-6-pyrazolo[1,5-c]pyrimidin-6-iumcarbonitrile IUPAC Name: 4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile Traditional Name: 4-amino-3-bromo-5-(2-chlorophenyl)-7-(3-pyridylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile Formula: C19H14BrClN7+ MolecularWeight: 455.71836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C3=C(C=NN3C(=[N+]2C#N)NCC4=CN=CC=C4)Br)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C3=C(C=NN3C(=[N+]2C#N)NCC4=CN=CC=C4)Br)N)Cl

InChI

InChI=1S/C19H13BrClN7/c20-14-10-26-28-18(14)16(23)17(13-5-1-2-6-15(13)21)27(11-22)19(28)25-9-12-4-3-7-24-8-12/h1-8,10H,9,23H2/p+1