N4-(2-bromophenyl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(2-bromophenyl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(2-bromophenyl)-N6-(3-pyridylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(2-bromophenyl)-N6-(3-pyridinylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(2-bromophenyl)-6-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(2-bromoanilino)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C16H15BrN6 MolecularWeight: 371.2345

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NCC3=CN=CC=C3)N)Br

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C(=NC=N2)NCC3=CN=CC=C3)N)Br

InChI

InChI=1S/C16H15BrN6/c17-12-5-1-2-6-13(12)23-16-14(18)15(21-10-22-16)20-9-11-4-3-7-19-8-11/h1-8,10H,9,18H2,(H2,20,21,22,23)