6-(4-fluorophenyl)sulfanyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol

Systemtic Name: 6-(4-fluorophenyl)sulfanyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol Openeye Name: 6-(4-fluorophenyl)sulfanyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol CAS Name: 6-[(4-fluorophenyl)thio]-3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol IUPAC Name: 6-(4-fluorophenyl)sulfanyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol Traditional Name: 6-[(4-fluorophenyl)thio]-3-methyl-1,2,4,5-tetrahydro-3-benzazepine-7,8-diol Formula: C17H18FNO2S MolecularWeight: 319.393723

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC(=C(C(=C2CC1)SC3=CC=C(C=C3)F)O)O

Isomeric SMILES

CN1CCC2=CC(=C(C(=C2CC1)SC3=CC=C(C=C3)F)O)O

InChI

InChI=1S/C17H18FNO2S/c1-19-8-6-11-10-15(20)16(21)17(14(11)7-9-19)22-13-4-2-12(18)3-5-13/h2-5,10,20-21H,6-9H2,1H3