3-(4-chlorophenyl)sulfanyl-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 3-[(4-chlorophenyl)thio]-1-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 3-[(4-chlorophenyl)thio]-1-[4-(2-nitrophenyl)sulfonylpiperazino]propan-1-one Formula: C19H20ClN3O5S2 MolecularWeight: 469.9622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCSC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CCSC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O5S2/c20-15-5-7-16(8-6-15)29-14-9-19(24)21-10-12-22(13-11-21)30(27,28)18-4-2-1-3-17(18)23(25)26/h1-8H,9-14H2