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

Systemtic Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone Openeye Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone CAS Name: 1-[4-(4-nitrophenyl)-1-piperazinyl]-2-[(2-nitrophenyl)thio]ethanone IUPAC Name: 1-[4-(4-nitrophenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanylethanone Traditional Name: 1-[4-(4-nitrophenyl)piperazino]-2-[(2-nitrophenyl)thio]ethanone Formula: C18H18N4O5S MolecularWeight: 402.42432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O5S/c23-18(13-28-17-4-2-1-3-16(17)22(26)27)20-11-9-19(10-12-20)14-5-7-15(8-6-14)21(24)25/h1-8H,9-13H2