1-methyl-1-(3-methylphenyl)-3-(4-sulfamoylphenyl)-3-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiourea

Systemtic Name: 1-methyl-1-(3-methylphenyl)-3-(4-sulfamoylphenyl)-3-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiourea Openeye Name: 1-methyl-1-(m-tolyl)-3-(4-sulfamoylphenyl)-3-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiourea CAS Name: 1-methyl-1-(3-methylphenyl)-3-(4-sulfamoylphenyl)-3-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiourea IUPAC Name: 1-methyl-1-(3-methylphenyl)-3-(4-sulfamoylphenyl)-3-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiourea Traditional Name: 1-methyl-1-(m-tolyl)-3-(4-sulfamoylphenyl)-3-[5-(trifluoromethyl)-1H-pyrazol-3-yl]thiourea Formula: C19H18F3N5O2S2 MolecularWeight: 469.50373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C)C(=S)N(C2=CC=C(C=C2)S(=O)(=O)N)C3=NNC(=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)N(C)C(=S)N(C2=CC=C(C=C2)S(=O)(=O)N)C3=NNC(=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3N5O2S2/c1-12-4-3-5-14(10-12)26(2)18(30)27(17-11-16(24-25-17)19(20,21)22)13-6-8-15(9-7-13)31(23,28)29/h3-11H,1-2H3,(H,24,25)(H2,23,28,29)