N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]aniline

Systemtic Name: N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]aniline Openeye Name: N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]aniline CAS Name: N-methyl-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]aniline IUPAC Name: N-methyl-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[[4-(trifluoromethyl)phenyl]methyl]aniline Traditional Name: methyl-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]-[4-(trifluoromethyl)benzyl]amine Formula: C20H23F3N4O4S MolecularWeight: 472.48123

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=CC=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H23F3N4O4S/c1-24-9-11-26(12-10-24)32(30,31)17-7-8-18(19(13-17)27(28)29)25(2)14-15-3-5-16(6-4-15)20(21,22)23/h3-8,13H,9-12,14H2,1-2H3