Vitas-M small molecule compound
4-[({1-[3-(trifluoromethyl)benzyl]-1H-1,2,4-triazol-3-yl}carbamothioyl)amino]benzenesulfonamide
Catalog ID
STK456649
SMILES S=C(Nc1ncn(n1)Cc1cccc(c1)C(F)(F)F)Nc1ccc(cc1)S(=O)(=O)N
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H15F3N6O2S2 MW 456.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F3N6O2S2/c18-17(19,20)12-3-1-2-11(8-12)9-26-10-22-15(25-26)24-16(29)23-13-4-6-14(7-5-13)30(21,27)28/h1-8,10H,9H2,(H2,21,27,28)(H2,23,24,25,29)InChIKey
RSWQVJIFAVLVFP-UHFFFAOYSA-NSynonyms
1(4SULFAMOYLPHENYL)3(1((3(TRIFLUOROMETHYL)PHENYL)METHYL)124TRIAZOL3YL)THIOUREA
4(((1(3(trifluoromethyl)benzyl)1H124triazol3yl)carbamothioyl)amino)benzenesulfonamide
4((THIOXO((1((3(TRIFLUOROMETHYL)PHENYL)METHYL)(124TRIAZOL3YL))AMINO)METHYL)AMINO)BENZENESULFONAMIDE
C1=CC(=CC(=C1)C(F)(F)F)CN2C=NC(=N2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N
InChI=1SC17H15F3N6O2S2c1817(1920)1231211(812)926102215(2526)2416(29)23134614(7513)30(2127)28h1810H9H2(H2212728)(H223242529)
MFCD05100594
ZINC000002856865
ZINC02856865
ZINC2856865
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