N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethanamide

Systemtic Name: N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethanamide Openeye Name: N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetamide CAS Name: N-[(4,6-dimethyl-2-pyrimidinyl)methyl]-2-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetamide IUPAC Name: N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetamide Traditional Name: N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)acetamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CC(=O)NCC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CC(=O)NCC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C21H28N4O3/c1-5-17-12-25(11-16-9-18(27-4)6-7-19(16)28-17)13-21(26)22-10-20-23-14(2)8-15(3)24-20/h6-9,17H,5,10-13H2,1-4H3,(H,22,26)