6-[2-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3,5-dimethylanilino)pyrimidin-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(3,5-dimethylanilino)-4-pyrimidinyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3,5-dimethylanilino)pyrimidin-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3,5-dimethylanilino)pyrimidin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC4=C(C=C3)OCC(=O)N4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC4=C(C=C3)OCC(=O)N4)C

InChI

InChI=1S/C20H18N4O2/c1-12-7-13(2)9-15(8-12)22-20-21-6-5-16(24-20)14-3-4-18-17(10-14)23-19(25)11-26-18/h3-10H,11H2,1-2H3,(H,23,25)(H,21,22,24)