[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2-phenylsulfanyl-3-pyridyl)methanone CAS Name: [4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-[2-(phenylthio)-3-pyridinyl]methanone IUPAC Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(2-phenylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(2-nitrophenyl)sulfonylpiperazino]-[2-(phenylthio)-3-pyridyl]methanone Formula: C22H20N4O5S2 MolecularWeight: 484.548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O5S2/c27-22(18-9-6-12-23-21(18)32-17-7-2-1-3-8-17)24-13-15-25(16-14-24)33(30,31)20-11-5-4-10-19(20)26(28)29/h1-12H,13-16H2