N6-[(4-chlorophenyl)methyl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-[(4-chlorophenyl)methyl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N6-[(4-chlorophenyl)methyl]-N4-(3-pyridylmethyl)pyrimidine-4,5,6-triamine CAS Name: N6-[(4-chlorophenyl)methyl]-N4-(3-pyridinylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-[(4-chlorophenyl)methyl]-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-[(4-chlorobenzyl)amino]pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C17H17ClN6 MolecularWeight: 340.81008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=NC=NC(=C2N)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)CNC2=NC=NC(=C2N)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN6/c18-14-5-3-12(4-6-14)9-21-16-15(19)17(24-11-23-16)22-10-13-2-1-7-20-8-13/h1-8,11H,9-10,19H2,(H2,21,22,23,24)