Vitas-M small molecule compound
2-chloro-4-methyl-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Catalog ID
STK251977
SMILES S=C(Nc1cc(ccc1N1CCCC1)C(F)(F)F)NC(=O)c1ccc(cc1Cl)C
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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 C20H19ClF3N3OS MW 441.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClF3N3OS/c1-12-4-6-14(15(21)10-12)18(28)26-19(29)25-16-11-13(20(22,23)24)5-7-17(16)27-8-2-3-9-27/h4-7,10-11H,2-3,8-9H2,1H3,(H2,25,26,28,29)InChIKey
AESQEDVBCBJQND-UHFFFAOYSA-NSynonyms
(2CHLORO4METHYLPHENYL)N(((2PYRROLIDINYL5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
2CHLORO4METHYLN((2(PYRROLIDIN1YL)5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
2CHLORO4METHYLN((2PYRROLIDIN1YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3)Cl
InChI=1SC20H19ClF3N3OSc1124614(15(21)1012)18(28)2619(29)25161113(20(2223)24)5717(16)27823927h471011H2389H21H3(H225262829)
MFCD03649973
ZINC000001854736
ZINC01854736
ZINC1854736
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