4-chloranyl-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidin-5-amine

Systemtic Name: 4-chloranyl-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidin-5-amine Openeye Name: 4-chloro-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidin-5-amine CAS Name: 4-chloro-6-[1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolyl]-5-pyrimidinamine IUPAC Name: 4-chloro-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidin-5-amine Traditional Name: [4-[5-(5-amino-6-chloro-pyrimidin-4-yl)benzimidazol-1-yl]pyrimidin-2-yl]-(1-phenylethyl)amine Formula: C23H19ClN8 MolecularWeight: 442.90356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=C(C(=NC=N5)Cl)N

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=C(C(=NC=N5)Cl)N

InChI

InChI=1S/C23H19ClN8/c1-14(15-5-3-2-4-6-15)30-23-26-10-9-19(31-23)32-13-29-17-11-16(7-8-18(17)32)21-20(25)22(24)28-12-27-21/h2-14H,25H2,1H3,(H,26,30,31)