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

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-[(5-methoxy-2-oxidanyl-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-hydroxy-5-methoxy-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-hydroxy-5-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-hydroxy-5-methoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-(2-hydroxy-5-methoxy-benzyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)CN2CCOC3=C(C2)C=C(C=C3O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC(=C(C=C1)O)CN2CCOC3=C(C2)C=C(C=C3O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H22N2O4S/c1-29-18-6-7-20(27)16(11-18)13-26-8-9-30-23-17(14-26)10-15(12-21(23)28)24-25-19-4-2-3-5-22(19)31-24/h2-7,10-12,27-28H,8-9,13-14H2,1H3