1-[7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone

Systemtic Name: 1-[7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone Openeye Name: 1-[7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone CAS Name: 1-[7-(3,6-dimethyl-2-pyrazinyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methyl-1-pyrazolyl)ethanone IUPAC Name: 1-[7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone Traditional Name: 1-[7-(3,6-dimethylpyrazin-2-yl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(5-methylpyrazol-1-yl)ethanone Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1CC(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CN=C4C)C

Isomeric SMILES

CC1=CC=NN1CC(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=NC(=CN=C4C)C

InChI

InChI=1S/C22H25N5O3/c1-14-11-23-16(3)21(25-14)17-9-18-12-26(7-8-30-22(18)19(10-17)29-4)20(28)13-27-15(2)5-6-24-27/h5-6,9-11H,7-8,12-13H2,1-4H3