[4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: [4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [4-(4-fluorophenyl)sulfonyl-3-nitrophenyl]-[2-methyl-4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(4-fluorophenyl)sulfonyl-3-nitrophenyl]-[2-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: [4-(4-fluorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(m-tolyl)piperazino]methanone Formula: C25H24FN3O5S MolecularWeight: 497.538563

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])C4=CC=CC(=C4)C

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])C4=CC=CC(=C4)C

InChI

InChI=1S/C25H24FN3O5S/c1-17-4-3-5-21(14-17)27-12-13-28(18(2)16-27)25(30)19-6-11-24(23(15-19)29(31)32)35(33,34)22-9-7-20(26)8-10-22/h3-11,14-15,18H,12-13,16H2,1-2H3