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

Systemtic Name: 6-[2-[(3-phenylphenyl)amino]pyrimidin-4-yl]-4-(pyridin-3-ylmethyl)-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3-phenylanilino)pyrimidin-4-yl]-4-(3-pyridylmethyl)-1,4-benzoxazin-3-one CAS Name: 6-[2-(3-phenylanilino)-4-pyrimidinyl]-4-(3-pyridinylmethyl)-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3-phenylanilino)pyrimidin-4-yl]-4-(pyridin-3-ylmethyl)-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3-phenylanilino)pyrimidin-4-yl]-4-(3-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=CN=CC=C6

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)C3=NC(=NC=C3)NC4=CC=CC(=C4)C5=CC=CC=C5)CC6=CN=CC=C6

InChI

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