1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-[(2-nitrophenyl)thio]ethanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanylethanone Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-[(2-nitrophenyl)thio]ethanone Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)CSC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H18ClN3O3S/c19-14-4-3-5-15(12-14)20-8-10-21(11-9-20)18(23)13-26-17-7-2-1-6-16(17)22(24)25/h1-7,12H,8-11,13H2