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

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-ethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-ethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-ethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-[(2-ethoxyphenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-(2-ethoxybenzyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C25H24N2O3S MolecularWeight: 432.53466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCOC3=C(C2)C=C(C=C3O)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCOC3=C(C2)C=C(C=C3O)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H24N2O3S/c1-2-29-22-9-5-3-7-17(22)15-27-11-12-30-24-19(16-27)13-18(14-21(24)28)25-26-20-8-4-6-10-23(20)31-25/h3-10,13-14,28H,2,11-12,15-16H2,1H3