N-[3-(2-methylpyrimidin-4-yl)phenyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[3-(2-methyl-4-pyrimidinyl)phenyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-N-[3-(2-methylpyrimidin-4-yl)phenyl]propionamide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CCN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NC(=O)CCN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C22H20N4O3/c1-15-23-11-9-18(24-15)16-5-4-6-17(13-16)25-21(27)10-12-26-19-7-2-3-8-20(19)29-14-22(26)28/h2-9,11,13H,10,12,14H2,1H3,(H,25,27)