Vitas-M small molecule compound
propan-2-yl 2-{[(2E)-2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK999727
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)C(F)(F)F)/C(=O)Nc1sc2c(c1C(=O)OC(C)C)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 C27H23F3N2O4S MW 528.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23F3N2O4S/c1-15(2)35-26(34)23-20-8-3-4-9-22(20)37-25(23)32-24(33)17(14-31)13-19-10-11-21(36-19)16-6-5-7-18(12-16)27(28,29)30/h5-7,10-13,15H,3-4,8-9H2,1-2H3,(H,32,33)/b17-13+InChIKey
LWYJBPMGHLUXSZ-GHRIWEEISA-NSynonyms
497241-27-7(E)isopropyl2(2cyano3(5(3(trifluoromethyl)phenyl)furan2yl)acrylamido)4567tetrahydrobenzo(b)thiophene3carboxylate
497241277
CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)C#N
InChI=1SC27H23F3N2O4Sc115(2)3526(34)2320834922(20)3725(23)3224(33)17(1431)1319101121(3619)1665718(1216)27(2829)30h57101315H3489H212H3(H3233)b1713+
MFCD03300058
N#CC(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2
propan2yl2(((2E)2cyano3(5(3(trifluoromethyl)phenyl)furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(((E)2cyano3(5(3(trifluoromethyl)phenyl)furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002334604
ZINC2334604
Check stock
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