Vitas-M small molecule compound
propan-2-yl 2-({(2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL021022
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/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 C26H23N3O6S MW 505.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O6S/c1-15(2)34-26(31)23-20-8-3-4-9-22(20)36-25(23)28-24(30)17(14-27)13-19-10-11-21(35-19)16-6-5-7-18(12-16)29(32)33/h5-7,10-13,15H,3-4,8-9H2,1-2H3,(H,28,30)/b17-13+InChIKey
JBYLFXZZFOPMBD-GHRIWEEISA-NSynonyms
488734-47-0(E)isopropyl2(2cyano3(5(3nitrophenyl)furan2yl)acrylamido)4567tetrahydrobenzo(b)thiophene3carboxylate
488734470
CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=CC3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O))C#N
InChI=1SC26H23N3O6Sc115(2)3426(31)2320834922(20)3625(23)2824(30)17(1427)1319101121(3519)1665718(1216)29(32)33h57101315H3489H212H3(H2830)b1713+
MFCD03292059
N#CC(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2
propan2yl2(((2E)2cyano3(5(3nitrophenyl)furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(((E)2cyano3(5(3nitrophenyl)furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002339649
ZINC02339649
ZINC2339649
Check stock
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Check stock on Vitas-MAvailable files
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