[4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylpiperazin-1-yl]-(5-nitrothiophen-2-yl)methanone

Systemtic Name: [4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]carbonylpiperazin-1-yl]-(5-nitrothiophen-2-yl)methanone Openeye Name: [4-[3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carbonyl]piperazin-1-yl]-(5-nitro-2-thienyl)methanone CAS Name: [4-[[3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-oxomethyl]-1-piperazinyl]-(5-nitro-2-thiophenyl)methanone IUPAC Name: [4-[3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carbonyl]piperazin-1-yl]-(5-nitrothiophen-2-yl)methanone Traditional Name: [4-[3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carbonyl]piperazino]-(5-nitro-2-thienyl)methanone Formula: C20H18FN5O4S2 MolecularWeight: 475.516423

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O4S2/c1-31-20-22-12-15(25(20)14-4-2-13(21)3-5-14)18(27)23-8-10-24(11-9-23)19(28)16-6-7-17(32-16)26(29)30/h2-7,12H,8-11H2,1H3