6-(2-phenylazanylpyrimidin-4-yl)-4-(pyridin-4-ylmethyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-(2-phenylazanylpyrimidin-4-yl)-4-(pyridin-4-ylmethyl)-1,4-benzoxazin-3-one Openeye Name: 6-(2-anilinopyrimidin-4-yl)-4-(4-pyridylmethyl)-1,4-benzoxazin-3-one CAS Name: 6-(2-anilino-4-pyrimidinyl)-4-(pyridin-4-ylmethyl)-1,4-benzoxazin-3-one IUPAC Name: 6-(2-anilinopyrimidin-4-yl)-4-(pyridin-4-ylmethyl)-1,4-benzoxazin-3-one Traditional Name: 6-(2-anilinopyrimidin-4-yl)-4-(4-pyridylmethyl)-1,4-benzoxazin-3-one Formula: C24H19N5O2 MolecularWeight: 409.43996

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)C3=NC(=NC=C3)NC4=CC=CC=C4)CC5=CC=NC=C5

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C3=NC(=NC=C3)NC4=CC=CC=C4)CC5=CC=NC=C5

InChI

InChI=1S/C24H19N5O2/c30-23-16-31-22-7-6-18(14-21(22)29(23)15-17-8-11-25-12-9-17)20-10-13-26-24(28-20)27-19-4-2-1-3-5-19/h1-14H,15-16H2,(H,26,27,28)