[9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1,3-thiazol-5-yl)methanone

Systemtic Name: [9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1,3-thiazol-5-yl)methanone Openeye Name: [9-methoxy-7-(p-tolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-thiazol-5-yl-methanone CAS Name: [9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(5-thiazolyl)methanone IUPAC Name: [9-methoxy-7-(4-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(1,3-thiazol-5-yl)methanone Traditional Name: [9-methoxy-7-(p-tolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-thiazol-5-yl-methanone Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)C4=CN=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)C(=O)C4=CN=CS4

InChI

InChI=1S/C21H20N2O3S/c1-14-3-5-15(6-4-14)16-9-17-12-23(21(24)19-11-22-13-27-19)7-8-26-20(17)18(10-16)25-2/h3-6,9-11,13H,7-8,12H2,1-2H3