Vitas-M small molecule compound
methyl 2-({(2E)-2-cyano-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK949502
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])/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 C24H19N3O6S MW 477.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O6S/c1-32-24(29)21-18-4-2-3-5-20(18)34-23(21)26-22(28)15(13-25)12-17-10-11-19(33-17)14-6-8-16(9-7-14)27(30)31/h6-12H,2-5H2,1H3,(H,26,28)/b15-12+InChIKey
OVSLHQJBMYMKEG-NTCAYCPXSA-NSynonyms
468748-93-8468748938
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O))C#N
InChI=1SC24H19N3O6Sc13224(29)2118423520(18)3423(21)2622(28)15(1325)1217101119(3317)146816(9714)27(30)31h612H25H21H3(H2628)b1512+
methyl2(((2E)2cyano3(5(4nitrophenyl)furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(((E)2cyano3(5(4nitrophenyl)furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02370941
N#CC(=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O))C(=O)Nc1sc2c(c1C(=O)OC)CCCC2
ZINC000002669788
ZINC02669788
ZINC2669788
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