8-bromanyl-5-(1H-imidazol-5-ylmethyl)-2-(2-phenylmethoxyphenyl)-3,4-dihydro-1,2,5-benzothiadiazepine

Systemtic Name: 8-bromanyl-5-(1H-imidazol-5-ylmethyl)-2-(2-phenylmethoxyphenyl)-3,4-dihydro-1,2,5-benzothiadiazepine Openeye Name: 2-(2-benzyloxyphenyl)-8-bromo-5-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine CAS Name: 8-bromo-5-(1H-imidazol-5-ylmethyl)-2-(2-phenylmethoxyphenyl)-3,4-dihydro-1,2,5-benzothiadiazepine IUPAC Name: 8-bromo-5-(1H-imidazol-5-ylmethyl)-2-(2-phenylmethoxyphenyl)-3,4-dihydro-1,2,5-benzothiadiazepine Traditional Name: 2-(2-benzoxyphenyl)-8-bromo-5-(1H-imidazol-5-ylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine Formula: C25H23BrN4OS MolecularWeight: 507.44532

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(SC2=C(N1CC3=CN=CN3)C=CC(=C2)Br)C4=CC=CC=C4OCC5=CC=CC=C5

Isomeric SMILES

C1CN(SC2=C(N1CC3=CN=CN3)C=CC(=C2)Br)C4=CC=CC=C4OCC5=CC=CC=C5

InChI

InChI=1S/C25H23BrN4OS/c26-20-10-11-23-25(14-20)32-30(13-12-29(23)16-21-15-27-18-28-21)22-8-4-5-9-24(22)31-17-19-6-2-1-3-7-19/h1-11,14-15,18H,12-13,16-17H2,(H,27,28)