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

Systemtic Name: N4-(4-iodophenyl)-N6-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(4-iodophenyl)-N6-(3-pyridylmethyl)pyrimidine-4,5,6-triamine CAS Name: N4-(4-iodophenyl)-N6-(3-pyridinylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(4-iodophenyl)-6-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-iodoanilino)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C16H15IN6 MolecularWeight: 418.23497

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=NC=NC(=C2N)NC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC(=CN=C1)CNC2=NC=NC(=C2N)NC3=CC=C(C=C3)I

InChI

InChI=1S/C16H15IN6/c17-12-3-5-13(6-4-12)23-16-14(18)15(21-10-22-16)20-9-11-2-1-7-19-8-11/h1-8,10H,9,18H2,(H2,20,21,22,23)