N-(3-chlorophenyl)-4-[2-(3-imidazol-1-ylpropylamino)pyridin-3-yl]pyrimidin-2-amine

Systemtic Name: N-(3-chlorophenyl)-4-[2-(3-imidazol-1-ylpropylamino)pyridin-3-yl]pyrimidin-2-amine Openeye Name: N-(3-chlorophenyl)-4-[2-(3-imidazol-1-ylpropylamino)-3-pyridyl]pyrimidin-2-amine CAS Name: N-(3-chlorophenyl)-4-[2-[3-(1-imidazolyl)propylamino]-3-pyridinyl]-2-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-4-[2-(3-imidazol-1-ylpropylamino)pyridin-3-yl]pyrimidin-2-amine Traditional Name: [3-[2-(3-chloroanilino)pyrimidin-4-yl]-2-pyridyl]-(3-imidazol-1-ylpropyl)amine Formula: C21H20ClN7 MolecularWeight: 405.8834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=C(N=CC=C3)NCCCN4C=CN=C4

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=C(N=CC=C3)NCCCN4C=CN=C4

InChI

InChI=1S/C21H20ClN7/c22-16-4-1-5-17(14-16)27-21-26-10-7-19(28-21)18-6-2-8-24-20(18)25-9-3-12-29-13-11-23-15-29/h1-2,4-8,10-11,13-15H,3,9,12H2,(H,24,25)(H,26,27,28)