Vitas-M small molecule compound
ethyl 4-cyano-3-methyl-5-({[5-(3-nitrophenyl)furan-2-yl]carbonyl}amino)thiophene-2-carboxylate
Catalog ID
STK355385
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)c1ccc(o1)c1cccc(c1)[N+](=O)[O-]
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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 C20H15N3O6S MW 425.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O6S/c1-3-28-20(25)17-11(2)14(10-21)19(30-17)22-18(24)16-8-7-15(29-16)12-5-4-6-13(9-12)23(26)27/h4-9H,3H2,1-2H3,(H,22,24)InChIKey
PFZLMIHPPWKGEW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C(=C(S1)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C#N)C
CCOC(=O)c1sc(c(c1C)C#N)NC(=O)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
ethyl4cyano3methyl5(((5(3nitrophenyl)furan2yl)carbonyl)amino)thiophene2carboxylate
ETHYL4CYANO3METHYL5((5(3NITROPHENYL)FURAN2CARBONYL)AMINO)THIOPHENE2CARBOXYLATE
InChI=1SC20H15N3O6Sc132820(25)1711(2)14(1021)19(3017)2218(24)168715(2916)1254613(912)23(26)27h49H3H212H3(H2224)
MFCD05830469
ZINC000016394044
ZINC16394044
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