Vitas-M small molecule compound
ethyl (2Z)-7-methyl-3-oxo-5-(thiophen-2-yl)-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK667055
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc(o1)c1cccc(c1)C(F)(F)F)/s2
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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 C26H19F3N2O4S2 MW 544.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19F3N2O4S2/c1-3-34-24(33)21-14(2)30-25-31(22(21)19-8-5-11-36-19)23(32)20(37-25)13-17-9-10-18(35-17)15-6-4-7-16(12-15)26(27,28)29/h4-13,22H,3H2,1-2H3/b20-13-InChIKey
LIMNJHRLJXETIC-MOSHPQCFSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)C(F)(F)F)S2)C
ethyl(2Z)7methyl3oxo5(thiophen2yl)2((5(3(trifluoromethyl)phenyl)furan2yl)methylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL3OXO5THIOPHEN2YL2((5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H19F3N2O4S2c133424(33)2114(2)302531(22(21)1985113619)23(32)20(3725)131791018(3517)1564716(1215)26(2728)29h41322H3H212H3b2013
MFCD05037662
ZINC000002992648
ZINC000002992650
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