N-(6-chloranylpyridin-3-yl)-4-(3-pyridin-3-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine

Systemtic Name: N-(6-chloranylpyridin-3-yl)-4-(3-pyridin-3-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine Openeye Name: N-(6-chloro-3-pyridyl)-4-[3-(3-pyridyl)-2,1-benzoxazol-5-yl]pyrimidin-2-amine CAS Name: N-(6-chloro-3-pyridinyl)-4-[3-(3-pyridinyl)-2,1-benzoxazol-5-yl]-2-pyrimidinamine IUPAC Name: N-(6-chloropyridin-3-yl)-4-(3-pyridin-3-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine Traditional Name: (6-chloro-3-pyridyl)-[4-[3-(3-pyridyl)anthranil-5-yl]pyrimidin-2-yl]amine Formula: C21H13ClN6O MolecularWeight: 400.82052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC5=CN=C(C=C5)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC5=CN=C(C=C5)Cl

InChI

InChI=1S/C21H13ClN6O/c22-19-6-4-15(12-25-19)26-21-24-9-7-17(27-21)13-3-5-18-16(10-13)20(29-28-18)14-2-1-8-23-11-14/h1-12H,(H,24,26,27)