6-(4-fluorophenyl)sulfanyl-3-methyl-9-nitro-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 6-(4-fluorophenyl)sulfanyl-3-methyl-9-nitro-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 6-(4-fluorophenyl)sulfanyl-3-methyl-9-nitro-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 6-[(4-fluorophenyl)thio]-3-methyl-9-nitro-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 6-(4-fluorophenyl)sulfanyl-3-methyl-9-nitro-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 6-[(4-fluorophenyl)thio]-3-methyl-9-nitro-1,2,4,5-tetrahydro-3-benzazepine Formula: C17H17FN2O2S MolecularWeight: 332.392483

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C=CC(=C2CC1)SC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CN1CCC2=C(C=CC(=C2CC1)SC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17FN2O2S/c1-19-10-8-14-15(9-11-19)17(7-6-16(14)20(21)22)23-13-4-2-12(18)3-5-13/h2-7H,8-11H2,1H3