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

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-methyl-2-benzimidazolyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CN3CCOC4=C(C3)C=C(C=C4O)C5=NC6=CC=CC=C6S5

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CN3CCOC4=C(C3)C=C(C=C4O)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C25H22N4O2S/c1-28-20-8-4-2-6-18(20)26-23(28)15-29-10-11-31-24-17(14-29)12-16(13-21(24)30)25-27-19-7-3-5-9-22(19)32-25/h2-9,12-13,30H,10-11,14-15H2,1H3