Vitas-M small molecule compound
2-({5-[2-chloro-5-(trifluoromethyl)phenyl]-1-methyl-1H-pyrrol-2-yl}carbonyl)-N-phenylhydrazinecarbothioamide
Catalog ID
STL109996
SMILES S=C(Nc1ccccc1)NNC(=O)c1ccc(n1C)c1cc(ccc1Cl)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 C20H16ClF3N4OS MW 452.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClF3N4OS/c1-28-16(14-11-12(20(22,23)24)7-8-15(14)21)9-10-17(28)18(29)26-27-19(30)25-13-5-3-2-4-6-13/h2-11H,1H3,(H,26,29)(H2,25,27,30)InChIKey
AAHJOAKZJLGYKK-UHFFFAOYSA-NSynonyms
1((5(2chloro5(trifluoromethyl)phenyl)1methylpyrrole2carbonyl)amino)3phenylthiourea
2((5(2chloro5(trifluoromethyl)phenyl)1methyl1Hpyrrol2yl)carbonyl)Nphenylhydrazinecarbothioamide
CN1C(=CC=C1C(=O)NNC(=S)NC2=CC=CC=C2)C3=C(C=CC(=C3)C(F)(F)F)Cl
InChI=1SC20H16ClF3N4OSc12816(141112(20(2223)24)7815(14)21)91017(28)18(29)262719(30)25135324613h211H1H3(H2629)(H2252730)
MFCD20744851
ZINC000067300036
ZINC67300036
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