Vitas-M small molecule compound
methyl 4,5-dimethyl-2-{[({2-methyl-3-[3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}amino)(oxo)acetyl]amino}thiophene-3-carboxylate
Catalog ID
STL395315
SMILES COC(=O)c1c(NC(=O)C(=O)NCC(Cn2ccc(n2)C(F)(F)F)C)sc(c1C)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 C18H21F3N4O4S MW 446.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21F3N4O4S/c1-9(8-25-6-5-12(24-25)18(19,20)21)7-22-14(26)15(27)23-16-13(17(28)29-4)10(2)11(3)30-16/h5-6,9H,7-8H2,1-4H3,(H,22,26)(H,23,27)InChIKey
WHUXMWIABGTJEO-UHFFFAOYSA-NSynonyms
1006332-90-61006332906
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=O)NCC(C)CN2C=CC(=N2)C(F)(F)F)C
InChI=1SC18H21F3N4O4Sc19(8256512(2425)18(1920)21)72214(26)15(27)231613(17(28)294)10(2)11(3)3016h569H78H214H3(H2226)(H2327)
METHYL45DIMETHYL2((((2METHYL3(3(TRIFLUOROMETHYL)1HPYRAZOL1YL)PROPYL)AMINO)(OXO)ACETYL)AMINO)THIOPHENE3CARBOXYLATE
methyl45dimethyl2((2((2methyl3(3(trifluoromethyl)pyrazol1yl)propyl)amino)2oxoacetyl)amino)thiophene3carboxylate
MFCD08557036
ZINC000036612471
ZINC000036612472
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