[3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [3-(4-fluorophenyl)-2-thioxo-1H-imidazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [3-(4-fluorophenyl)-2-sulfanylidene-1H-imidazol-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [3-(4-fluorophenyl)-2-thioxo-4-imidazolin-4-yl]-[4-(3-nitrophenyl)sulfonylpiperazino]methanone Formula: C20H18FN5O5S2 MolecularWeight: 491.515823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CNC(=S)N2C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O5S2/c21-14-4-6-15(7-5-14)25-18(13-22-20(25)32)19(27)23-8-10-24(11-9-23)33(30,31)17-3-1-2-16(12-17)26(28)29/h1-7,12-13H,8-11H2,(H,22,32)