5-(4-methylsulfanylphenyl)-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol

Systemtic Name: 5-(4-methylsulfanylphenyl)-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol Openeye Name: 3-allyl-5-(4-methylsulfanylphenyl)-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol CAS Name: 5-[4-(methylthio)phenyl]-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol IUPAC Name: 5-(4-methylsulfanylphenyl)-3-prop-2-enyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol Traditional Name: 3-allyl-5-[4-(methylthio)phenyl]-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol Formula: C20H23NO2S MolecularWeight: 341.46712

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2CN(CCC3=CC(=C(C=C23)O)O)CC=C

Isomeric SMILES

CSC1=CC=C(C=C1)C2CN(CCC3=CC(=C(C=C23)O)O)CC=C

InChI

InChI=1S/C20H23NO2S/c1-3-9-21-10-8-15-11-19(22)20(23)12-17(15)18(13-21)14-4-6-16(24-2)7-5-14/h3-7,11-12,18,22-23H,1,8-10,13H2,2H3