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

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-pyridin-2-ylpyrrol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-[[1-(2-pyridyl)pyrrol-2-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 7-(1,3-benzothiazol-2-yl)-4-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-[(1-pyridin-2-ylpyrrol-2-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-[[1-(2-pyridyl)pyrrol-2-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C26H22N4O2S MolecularWeight: 454.54348

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC3=CC=CN3C4=CC=CC=N4)C=C(C=C2O)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1COC2=C(CN1CC3=CC=CN3C4=CC=CC=N4)C=C(C=C2O)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C26H22N4O2S/c31-22-15-18(26-28-21-7-1-2-8-23(21)33-26)14-19-16-29(12-13-32-25(19)22)17-20-6-5-11-30(20)24-9-3-4-10-27-24/h1-11,14-15,31H,12-13,16-17H2