4-(1-benzothiophen-2-ylmethyl)-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 4-(1-benzothiophen-2-ylmethyl)-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-(benzothiophen-2-ylmethyl)-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-(1-benzothiophen-2-ylmethyl)-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-(1-benzothiophen-2-ylmethyl)-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-(benzothiophen-2-ylmethyl)-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C22H19NO2S2 MolecularWeight: 393.52176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC3=CC4=CC=CC=C4S3)C=C(C=C2O)C5=CC=CS5

Isomeric SMILES

C1COC2=C(CN1CC3=CC4=CC=CC=C4S3)C=C(C=C2O)C5=CC=CS5

InChI

InChI=1S/C22H19NO2S2/c24-19-12-16(20-6-3-9-26-20)10-17-13-23(7-8-25-22(17)19)14-18-11-15-4-1-2-5-21(15)27-18/h1-6,9-12,24H,7-8,13-14H2