Vitas-M small molecule compound
ethyl 4-[({3-amino-6-[4-(prop-2-en-1-yloxy)phenyl]-4-(trifluoromethyl)thieno[2,3-b]pyridin-2-yl}carbonyl)amino]benzoate
Catalog ID
STK813020
SMILES C=CCOc1ccc(cc1)c1nc2sc(c(c2c(c1)C(F)(F)F)N)C(=O)Nc1ccc(cc1)C(=O)OCC
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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 C27H22F3N3O4S MW 541.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22F3N3O4S/c1-3-13-37-18-11-7-15(8-12-18)20-14-19(27(28,29)30)21-22(31)23(38-25(21)33-20)24(34)32-17-9-5-16(6-10-17)26(35)36-4-2/h3,5-12,14H,1,4,13,31H2,2H3,(H,32,34)InChIKey
WHPKENZJXPELEV-UHFFFAOYSA-NSynonyms
609794-51-6609794516
CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3C(F)(F)F)C4=CC=C(C=C4)OCC=C)N
ethyl4(((3amino6(4(prop2en1yloxy)phenyl)4(trifluoromethyl)thieno(23b)pyridin2yl)carbonyl)amino)benzoate
ETHYL4((3AMINO6(4PROP2ENOXYPHENYL)4(TRIFLUOROMETHYL)THIENO(23B)PYRIDINE2CARBONYL)AMINO)BENZOATE
ETHYL4(6(4(ALLYLOXY)PHENYL)3AMINO4(TRIFLUOROMETHYL)THIENO(23B)PYRIDINE2CARBOXAMIDO)BENZOATE
InChI=1SC27H22F3N3O4Sc1313371811715(81218)201419(27(2829)30)2122(31)23(3825(21)3320)24(34)32179516(61017)26(35)3642h351214H141331H22H3(H3234)
MFCD03529202
ZINC000002508862
ZINC2508862
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