Vitas-M small molecule compound
1-(2,4-dichlorophenyl)-3-{1-[3-(trifluoromethyl)benzyl]-1H-1,2,4-triazol-3-yl}thiourea
Catalog ID
STK456314
SMILES S=C(Nc1ccc(cc1Cl)Cl)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 C17H12Cl2F3N5S MW 446.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12Cl2F3N5S/c18-12-4-5-14(13(19)7-12)24-16(28)25-15-23-9-27(26-15)8-10-2-1-3-11(6-10)17(20,21)22/h1-7,9H,8H2,(H2,24,25,26,28)InChIKey
ANBSEQYVQOBLBG-UHFFFAOYSA-NSynonyms
((24DICHLOROPHENYL)AMINO)((1((3(TRIFLUOROMETHYL)PHENYL)METHYL)(124TRIAZOL3YL))AMINO)METHANE1THIONE
1(24DICHLOROPHENYL)3(1((3(TRIFLUOROMETHYL)PHENYL)METHYL)124TRIAZOL3YL)THIOUREA
1(24dichlorophenyl)3(1(3(trifluoromethyl)benzyl)1H124triazol3yl)thiourea
C1=CC(=CC(=C1)C(F)(F)F)CN2C=NC(=N2)NC(=S)NC3=C(C=C(C=C3)Cl)Cl
InChI=1SC17H12Cl2F3N5Sc18124514(13(19)712)2416(28)251523927(2615)81021311(610)17(2021)22h179H8H2(H224252628)
MFCD05061400
ZINC000002852320
ZINC02852320
ZINC2852320
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