N-(3-chlorophenyl)-4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine

Systemtic Name: N-(3-chlorophenyl)-4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine Openeye Name: N-(3-chlorophenyl)-4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine CAS Name: N-(3-chlorophenyl)-4-[3-(4-pyrimidinyl)-2,1-benzoxazol-5-yl]-2-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-4-(3-pyrimidin-4-yl-2,1-benzoxazol-5-yl)pyrimidin-2-amine Traditional Name: (3-chlorophenyl)-[4-[3-(4-pyrimidyl)anthranil-5-yl]pyrimidin-2-yl]amine Formula: C21H13ClN6O MolecularWeight: 400.82052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=CC4=C(ON=C4C=C3)C5=NC=NC=C5

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=CC4=C(ON=C4C=C3)C5=NC=NC=C5

InChI

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