7-(1,3-benzothiazol-2-yl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-methoxy-2,3-dimethylphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-methoxy-2,3-dimethylphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-(4-methoxy-2,3-dimethyl-benzyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OC)CN2CCOC3=C(C2)C=C(C=C3O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=C(C=CC(=C1C)OC)CN2CCOC3=C(C2)C=C(C=C3O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H26N2O3S/c1-16-17(2)23(30-3)9-8-18(16)14-28-10-11-31-25-20(15-28)12-19(13-22(25)29)26-27-21-6-4-5-7-24(21)32-26/h4-9,12-13,29H,10-11,14-15H2,1-3H3