1-[4-(3-methylsulfanylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanol

Systemtic Name: 1-[4-(3-methylsulfanylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanol Openeye Name: 1-[4-(3-methylsulfanylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanol CAS Name: 1-[4-[3-(methylthio)propyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-2-phenylethanol IUPAC Name: 1-[4-(3-methylsulfanylpropyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-2-phenylethanol Traditional Name: 1-[4-[3-(methylthio)propyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-2-phenyl-ethanol Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCN1CCOC2=C(C1)C=C(C=C2)C(CC3=CC=CC=C3)O

Isomeric SMILES

CSCCCN1CCOC2=C(C1)C=C(C=C2)C(CC3=CC=CC=C3)O

InChI

InChI=1S/C21H27NO2S/c1-25-13-5-10-22-11-12-24-21-9-8-18(15-19(21)16-22)20(23)14-17-6-3-2-4-7-17/h2-4,6-9,15,20,23H,5,10-14,16H2,1H3