N1-[5-(3-methylphenyl)-4-pyridin-4-yl-pyrimidin-2-yl]-3-phenyl-propane-1,2-diamine hydrochloride

Systemtic Name: N1-[5-(3-methylphenyl)-4-pyridin-4-yl-pyrimidin-2-yl]-3-phenyl-propane-1,2-diamine hydrochloride Openeye Name: N1-[5-(m-tolyl)-4-(4-pyridyl)pyrimidin-2-yl]-3-phenyl-propane-1,2-diamine hydrochloride CAS Name: N1-[5-(3-methylphenyl)-4-pyridin-4-yl-2-pyrimidinyl]-3-phenylpropane-1,2-diamine hydrochloride IUPAC Name: 1-N-[5-(3-methylphenyl)-4-pyridin-4-ylpyrimidin-2-yl]-3-phenylpropane-1,2-diamine hydrochloride Traditional Name: (2-amino-3-phenyl-propyl)-[5-(m-tolyl)-4-(4-pyridyl)pyrimidin-2-yl]amine hydrochloride Formula: C25H26ClN5 MolecularWeight: 431.96044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CN=C(N=C2C3=CC=NC=C3)NCC(CC4=CC=CC=C4)N.Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=CN=C(N=C2C3=CC=NC=C3)NCC(CC4=CC=CC=C4)N.Cl

InChI

InChI=1S/C25H25N5.ClH/c1-18-6-5-9-21(14-18)23-17-29-25(30-24(23)20-10-12-27-13-11-20)28-16-22(26)15-19-7-3-2-4-8-19;/h2-14,17,22H,15-16,26H2,1H3,(H,28,29,30);1H