Vitas-M small molecule compound
1-(3-acetylphenyl)-3-{1-[3-(trifluoromethyl)benzyl]-1H-1,2,4-triazol-3-yl}thiourea
Catalog ID
STK335172
SMILES S=C(Nc1cccc(c1)C(=O)C)Nc1ncn(n1)Cc1cccc(c1)C(F)(F)F
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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 C19H16F3N5OS MW 419.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16F3N5OS/c1-12(28)14-5-3-7-16(9-14)24-18(29)25-17-23-11-27(26-17)10-13-4-2-6-15(8-13)19(20,21)22/h2-9,11H,10H2,1H3,(H2,24,25,26,29)InChIKey
SSQWNIQVNOSPFS-UHFFFAOYSA-NSynonyms
1(3ACETYLPHENYL)3(1((3(TRIFLUOROMETHYL)PHENYL)METHYL)124TRIAZOL3YL)THIOUREA
1(3acetylphenyl)3(1(3(trifluoromethyl)benzyl)1H124triazol3yl)thiourea
1ACETYL3((THIOXO((1((3(TRIFLUOROMETHYL)PHENYL)METHYL)(124TRIAZOL3YL))AMINO)METHYL)AMINO)BENZENE
CC(=O)C1=CC(=CC=C1)NC(=S)NC2=NN(C=N2)CC3=CC(=CC=C3)C(F)(F)F
InChI=1SC19H16F3N5OSc112(28)1453716(914)2418(29)2517231127(2617)101342615(813)19(2021)22h2911H10H21H3(H224252629)
MFCD05063445
ZINC000001121704
ZINC01121704
ZINC1121704
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