4-(2-morpholin-4-ylethyl)-6-[2-[(3-phenoxyphenyl)amino]pyrimidin-4-yl]-1,4-benzoxazin-3-one

Systemtic Name: 4-(2-morpholin-4-ylethyl)-6-[2-[(3-phenoxyphenyl)amino]pyrimidin-4-yl]-1,4-benzoxazin-3-one Openeye Name: 4-(2-morpholinoethyl)-6-[2-(3-phenoxyanilino)pyrimidin-4-yl]-1,4-benzoxazin-3-one CAS Name: 4-[2-(4-morpholinyl)ethyl]-6-[2-(3-phenoxyanilino)-4-pyrimidinyl]-1,4-benzoxazin-3-one IUPAC Name: 4-(2-morpholin-4-ylethyl)-6-[2-(3-phenoxyanilino)pyrimidin-4-yl]-1,4-benzoxazin-3-one Traditional Name: 4-(2-morpholinoethyl)-6-[2-(3-phenoxyanilino)pyrimidin-4-yl]-1,4-benzoxazin-3-one Formula: C30H29N5O4 MolecularWeight: 523.58236

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C(=O)COC3=C2C=C(C=C3)C4=NC(=NC=C4)NC5=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

C1COCCN1CCN2C(=O)COC3=C2C=C(C=C3)C4=NC(=NC=C4)NC5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C30H29N5O4/c36-29-21-38-28-10-9-22(19-27(28)35(29)14-13-34-15-17-37-18-16-34)26-11-12-31-30(33-26)32-23-5-4-8-25(20-23)39-24-6-2-1-3-7-24/h1-12,19-20H,13-18,21H2,(H,31,32,33)