3-[2-(azepan-1-ylcarbonyl)phenyl]sulfanyl-1-(4-bromophenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[2-(azepan-1-ylcarbonyl)phenyl]sulfanyl-1-(4-bromophenyl)pyrrolidine-2,5-dione Openeye Name: 3-[2-(azepane-1-carbonyl)phenyl]sulfanyl-1-(4-bromophenyl)pyrrolidine-2,5-dione CAS Name: 3-[[2-[1-azepanyl(oxo)methyl]phenyl]thio]-1-(4-bromophenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[2-(azepane-1-carbonyl)phenyl]sulfanyl-1-(4-bromophenyl)pyrrolidine-2,5-dione Traditional Name: 3-[[2-(azepane-1-carbonyl)phenyl]thio]-1-(4-bromophenyl)pyrrolidine-2,5-quinone Formula: C23H23BrN2O3S MolecularWeight: 487.40932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2SC3CC(=O)N(C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2SC3CC(=O)N(C3=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H23BrN2O3S/c24-16-9-11-17(12-10-16)26-21(27)15-20(23(26)29)30-19-8-4-3-7-18(19)22(28)25-13-5-1-2-6-14-25/h3-4,7-12,20H,1-2,5-6,13-15H2