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

Systemtic Name: 4-(1-benzothiophen-2-ylmethyl)-7-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 4-(benzothiophen-2-ylmethyl)-7-(2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 4-(1-benzothiophen-2-ylmethyl)-7-(2-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 4-(1-benzothiophen-2-ylmethyl)-7-pyridin-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 4-(benzothiophen-2-ylmethyl)-7-(2-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C23H20N2O2S MolecularWeight: 388.4821

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC3=CC4=CC=CC=C4S3)C=C(C=C2O)C5=CC=CC=N5

Isomeric SMILES

C1COC2=C(CN1CC3=CC4=CC=CC=C4S3)C=C(C=C2O)C5=CC=CC=N5

InChI

InChI=1S/C23H20N2O2S/c26-21-13-17(20-6-3-4-8-24-20)11-18-14-25(9-10-27-23(18)21)15-19-12-16-5-1-2-7-22(16)28-19/h1-8,11-13,26H,9-10,14-15H2