6-[2-[(3-phenylphenyl)amino]pyrimidin-4-yl]-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(3-phenylphenyl)amino]pyrimidin-4-yl]-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3-phenylanilino)pyrimidin-4-yl]-4-(2-pyridylmethyl)-1,4-benzoxazin-3-one CAS Name: 6-[2-(3-phenylanilino)-4-pyrimidinyl]-4-(2-pyridinylmethyl)-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-phenylanilino)pyrimidin-4-yl]-4-(pyridin-2-ylmethyl)-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3-phenylanilino)pyrimidin-4-yl]-4-(2-pyridylmethyl)-1,4-benzoxazin-3-one Formula: C30H23N5O2 MolecularWeight: 485.53592

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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)C5=CC=CC=C5)CC6=CC=CC=N6

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C3=NC(=NC=C3)NC4=CC=CC(=C4)C5=CC=CC=C5)CC6=CC=CC=N6

InChI

InChI=1S/C30H23N5O2/c36-29-20-37-28-13-12-23(18-27(28)35(29)19-25-10-4-5-15-31-25)26-14-16-32-30(34-26)33-24-11-6-9-22(17-24)21-7-2-1-3-8-21/h1-18H,19-20H2,(H,32,33,34)