N-methylethanamine; 4-phenyl-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-methylethanamine; 4-phenyl-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-methylethanamine; 4-phenyl-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-methylethanamine; 4-phenyl-2-(1-pyrazolyl)-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-methylethanamine; 4-phenyl-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Traditional Name: ethyl(methyl)amine; 4-phenyl-2-pyrazol-1-yl-3-(trifluoromethyl)benzenesulfonamide Formula: C19H21F3N4O2S MolecularWeight: 426.45585

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Descriptors Computed from Structure

Canonical SMILES:

CCNC.C1=CC=C(C=C1)C2=C(C(=C(C=C2)S(=O)(=O)N)N3C=CC=N3)C(F)(F)F

Isomeric SMILES

CCNC.C1=CC=C(C=C1)C2=C(C(=C(C=C2)S(=O)(=O)N)N3C=CC=N3)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S.C3H9N/c17-16(18,19)14-12(11-5-2-1-3-6-11)7-8-13(25(20,23)24)15(14)22-10-4-9-21-22;1-3-4-2/h1-10H,(H2,20,23,24);4H,3H2,1-2H3