Vitas-M small molecule compound
2-chloro-N-{[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]carbamothioyl}-4-nitrobenzamide
Catalog ID
STK254700
SMILES S=C(Nc1cc(ccc1N1CCOCC1)C(F)(F)F)NC(=O)c1ccc(cc1Cl)[N+](=O)[O-]
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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 C19H16ClF3N4O4S MW 488.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClF3N4O4S/c20-14-10-12(27(29)30)2-3-13(14)17(28)25-18(32)24-15-9-11(19(21,22)23)1-4-16(15)26-5-7-31-8-6-26/h1-4,9-10H,5-8H2,(H2,24,25,28,32)InChIKey
RNMNUYCAHOQKTN-UHFFFAOYSA-NSynonyms
2chloroN((2(morpholin4yl)5(trifluoromethyl)phenyl)carbamothioyl)4nitrobenzamide
2CHLORON((2MORPHOLIN4YL5(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)4NITROBENZAMIDE
C1COCCN1C2=C(C=C(C=C2)C(F)(F)F)NC(=S)NC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC19H16ClF3N4O4Sc20141012(27(29)30)2313(14)17(28)2518(32)2415911(19(2122)23)1416(15)2657318626h14910H58H2(H224252832)
MFCD03995141
S=C(Nc1cc(ccc1N1CCOCC1)C(F)(F)F)NC(=O)c1ccc(cc1Cl)(N+)(=O)(O)
ZINC000001142168
ZINC01142168
ZINC1142168
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