1-[(4-chlorophenyl)sulfanyl-(4-nitrophenyl)methyl]-4-phenyl-piperazine

Systemtic Name: 1-[(4-chlorophenyl)sulfanyl-(4-nitrophenyl)methyl]-4-phenyl-piperazine Openeye Name: 1-[(4-chlorophenyl)sulfanyl-(4-nitrophenyl)methyl]-4-phenyl-piperazine CAS Name: 1-[[(4-chlorophenyl)thio]-(4-nitrophenyl)methyl]-4-phenylpiperazine IUPAC Name: 1-[(4-chlorophenyl)sulfanyl-(4-nitrophenyl)methyl]-4-phenylpiperazine Traditional Name: 1-[[(4-chlorophenyl)thio]-(4-nitrophenyl)methyl]-4-phenyl-piperazine Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(C3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(C3=CC=C(C=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN3O2S/c24-19-8-12-22(13-9-19)30-23(18-6-10-21(11-7-18)27(28)29)26-16-14-25(15-17-26)20-4-2-1-3-5-20/h1-13,23H,14-17H2