[3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: [3-(4-fluorophenyl)-2-methylsulfanyl-imidazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: [3-(4-fluorophenyl)-2-(methylthio)-4-imidazolyl]-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: [3-(4-fluorophenyl)-2-methylsulfanylimidazol-4-yl]-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: [3-(4-fluorophenyl)-2-(methylthio)imidazol-4-yl]-[4-(4-nitrophenyl)piperazino]methanone Formula: C21H20FN5O3S MolecularWeight: 441.478603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20FN5O3S/c1-31-21-23-14-19(26(21)17-4-2-15(22)3-5-17)20(28)25-12-10-24(11-13-25)16-6-8-18(9-7-16)27(29)30/h2-9,14H,10-13H2,1H3