Vitas-M small molecule compound
3-chloro-4-methoxy-N-{[2-(pyrrolidin-1-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}benzamide
Catalog ID
STK251964
SMILES COc1ccc(cc1Cl)C(=O)NC(=S)Nc1cc(ccc1N1CCCC1)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 C20H19ClF3N3O2S MW 457.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClF3N3O2S/c1-29-17-7-4-12(10-14(17)21)18(28)26-19(30)25-15-11-13(20(22,23)24)5-6-16(15)27-8-2-3-9-27/h4-7,10-11H,2-3,8-9H2,1H3,(H2,25,26,28,30)InChIKey
RFSYCJBAJKAXMD-UHFFFAOYSA-NSynonyms
(3CHLORO4METHOXYPHENYL)N(((2PYRROLIDINYL5(TRIFLUOROMETHYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
3CHLORO4METHOXYN((2(PYRROLIDIN1YL)5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
3CHLORO4METHOXYN((2PYRROLIDIN1YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3)Cl
InChI=1SC20H19ClF3N3O2Sc129177412(1014(17)21)18(28)2619(30)25151113(20(2223)24)5616(15)27823927h471011H2389H21H3(H225262830)
MFCD03650507
ZINC000001256062
ZINC01256062
ZINC1256062
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