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

Systemtic Name: 6-(2-phenylazanylpyrimidin-4-yl)-4-(pyridin-3-ylmethyl)-1,4-benzoxazin-3-one Openeye Name: 6-(2-anilinopyrimidin-4-yl)-4-(3-pyridylmethyl)-1,4-benzoxazin-3-one CAS Name: 6-(2-anilino-4-pyrimidinyl)-4-(3-pyridinylmethyl)-1,4-benzoxazin-3-one IUPAC Name: 6-(2-anilinopyrimidin-4-yl)-4-(pyridin-3-ylmethyl)-1,4-benzoxazin-3-one Traditional Name: 6-(2-anilinopyrimidin-4-yl)-4-(3-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=CN=CC=C5

Isomeric SMILES

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

InChI

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