N-(6-chloranylpyridin-3-yl)-4-[3-[[(phenylmethyl)amino]methyl]phenyl]pyrimidin-2-amine

Systemtic Name: N-(6-chloranylpyridin-3-yl)-4-[3-[[(phenylmethyl)amino]methyl]phenyl]pyrimidin-2-amine Openeye Name: 4-[3-[(benzylamino)methyl]phenyl]-N-(6-chloro-3-pyridyl)pyrimidin-2-amine CAS Name: N-(6-chloro-3-pyridinyl)-4-[3-[[(phenylmethyl)amino]methyl]phenyl]-2-pyrimidinamine IUPAC Name: 4-[3-[(benzylamino)methyl]phenyl]-N-(6-chloropyridin-3-yl)pyrimidin-2-amine Traditional Name: benzyl-[3-[2-[(6-chloro-3-pyridyl)amino]pyrimidin-4-yl]benzyl]amine Formula: C23H20ClN5 MolecularWeight: 401.8914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC2=CC=CC(=C2)C3=NC(=NC=C3)NC4=CN=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNCC2=CC=CC(=C2)C3=NC(=NC=C3)NC4=CN=C(C=C4)Cl

InChI

InChI=1S/C23H20ClN5/c24-22-10-9-20(16-27-22)28-23-26-12-11-21(29-23)19-8-4-7-18(13-19)15-25-14-17-5-2-1-3-6-17/h1-13,16,25H,14-15H2,(H,26,28,29)