1-(3,4-dichlorophenyl)sulfonyl-4-(4-nitro-3-pyridin-2-ylsulfanyl-phenyl)piperazine

Systemtic Name: 1-(3,4-dichlorophenyl)sulfonyl-4-(4-nitro-3-pyridin-2-ylsulfanyl-phenyl)piperazine Openeye Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[4-nitro-3-(2-pyridylsulfanyl)phenyl]piperazine CAS Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[4-nitro-3-(2-pyridinylthio)phenyl]piperazine IUPAC Name: 1-(3,4-dichlorophenyl)sulfonyl-4-(4-nitro-3-pyridin-2-ylsulfanylphenyl)piperazine Traditional Name: 1-(3,4-dichlorophenyl)sulfonyl-4-[4-nitro-3-(2-pyridylthio)phenyl]piperazine Formula: C21H18Cl2N4O4S2 MolecularWeight: 525.42802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])SC3=CC=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])SC3=CC=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H18Cl2N4O4S2/c22-17-6-5-16(14-18(17)23)33(30,31)26-11-9-25(10-12-26)15-4-7-19(27(28)29)20(13-15)32-21-3-1-2-8-24-21/h1-8,13-14H,9-12H2