Vitas-M small molecule compound
methyl 2-{[(2Z)-3-{5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl}-2-cyanoprop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK739944
SMILES N#C/C(=C/c1ccc(o1)c1cc(ccc1Cl)C(F)(F)F)/C(=O)Nc1sc2c(c1C(=O)OC)CCCC2
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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 C25H18ClF3N2O4S MW 534.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClF3N2O4S/c1-34-24(33)21-16-4-2-3-5-20(16)36-23(21)31-22(32)13(12-30)10-15-7-9-19(35-15)17-11-14(25(27,28)29)6-8-18(17)26/h6-11H,2-5H2,1H3,(H,31,32)/b13-10-InChIKey
IWCRXXQLKGSYAE-RAXLEYEMSA-NSynonyms
(E)methyl2(3(5(2chloro5(trifluoromethyl)phenyl)furan2yl)2cyanoacrylamido)4567tetrahydrobenzo(b)thiophene3carboxylate
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)C(F)(F)F)Cl)C#N
InChI=1SC25H18ClF3N2O4Sc13424(33)2116423520(16)3623(21)3122(32)13(1230)10157919(3515)171114(25(2728)29)6818(17)26h611H25H21H3(H3132)b1310
methyl2(((2Z)3(5(2chloro5(trifluoromethyl)phenyl)furan2yl)2cyanoprop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(((Z)3(5(2chloro5(trifluoromethyl)phenyl)furan2yl)2cyanoprop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD13371841
N#CC(=Cc1ccc(o1)c1cc(ccc1Cl)C(F)(F)F)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2
ZINC000004480299
ZINC4480299
Check stock
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