4-methylsulfonyl-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-2-nitro-aniline

Systemtic Name: 4-methylsulfonyl-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-2-nitro-aniline Openeye Name: 4-methylsulfonyl-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-2-nitro-aniline CAS Name: 4-methylsulfonyl-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]ethyl]-2-nitroaniline IUPAC Name: 4-methylsulfonyl-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]amine Formula: C20H19F3N4O4S MolecularWeight: 468.44947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(C)NC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(C)NC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H19F3N4O4S/c1-12(25-18-8-7-16(32(3,30)31)10-19(18)27(28)29)17-11-24-26(13(17)2)15-6-4-5-14(9-15)20(21,22)23/h4-12,25H,1-3H3