1-(9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanone

Systemtic Name: 1-(9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanone Openeye Name: 1-[9-methoxy-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(2-methylthiazol-4-yl)ethanone CAS Name: 1-[9-methoxy-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(2-methyl-4-thiazolyl)ethanone IUPAC Name: 1-(9-methoxy-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanone Traditional Name: 1-[9-methoxy-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-2-(2-methylthiazol-4-yl)ethanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CN=CC=C4

Isomeric SMILES

CC1=NC(=CS1)CC(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CN=CC=C4

InChI

InChI=1S/C21H21N3O3S/c1-14-23-18(13-28-14)10-20(25)24-6-7-27-21-17(12-24)8-16(9-19(21)26-2)15-4-3-5-22-11-15/h3-5,8-9,11,13H,6-7,10,12H2,1-2H3