[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-[5-(phenylsulfanylmethyl)furan-2-yl]methanone

Systemtic Name: [4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-[5-(phenylsulfanylmethyl)furan-2-yl]methanone Openeye Name: [4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-[5-(phenylsulfanylmethyl)-2-furyl]methanone CAS Name: [4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-[5-[(phenylthio)methyl]-2-furanyl]methanone IUPAC Name: [4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-[5-(phenylsulfanylmethyl)furan-2-yl]methanone Traditional Name: [4-(3-nitrophenyl)sulfonylpiperazino]-[5-[(phenylthio)methyl]-2-furyl]methanone Formula: C22H21N3O6S2 MolecularWeight: 487.54864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(O2)CSC3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(O2)CSC3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O6S2/c26-22(21-10-9-18(31-21)16-32-19-6-2-1-3-7-19)23-11-13-24(14-12-23)33(29,30)20-8-4-5-17(15-20)25(27)28/h1-10,15H,11-14,16H2