3-methyl-9-nitro-6-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 3-methyl-9-nitro-6-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-methyl-9-nitro-6-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 3-methyl-9-nitro-6-(phenylthio)-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 3-methyl-9-nitro-6-phenylsulfanyl-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-methyl-9-nitro-6-(phenylthio)-1,2,4,5-tetrahydro-3-benzazepine Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O2S/c1-18-11-9-14-15(10-12-18)17(8-7-16(14)19(20)21)22-13-5-3-2-4-6-13/h2-8H,9-12H2,1H3