Vitas-M small molecule compound
methyl 4-(4-chlorophenyl)-5-methyl-2-{[(2E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STL171849
SMILES COC(=O)c1c(NC(=O)/C=C/c2ccc(o2)[N+](=O)[O-])sc(c1c1ccc(cc1)Cl)C
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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 C20H15ClN2O6S MW 446.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O6S/c1-11-17(12-3-5-13(21)6-4-12)18(20(25)28-2)19(30-11)22-15(24)9-7-14-8-10-16(29-14)23(26)27/h3-10H,1-2H3,(H,22,24)/b9-7+InChIKey
HYXRHSYJZZYLKU-VQHVLOKHSA-NSynonyms
514841-85-1514841851
CC1=C(C(=C(S1)NC(=O)C=CC2=CC=C(O2)(N+)(=O)(O))C(=O)OC)C3=CC=C(C=C3)Cl
COC(=O)c1c(NC(=O)C=Cc2ccc(o2)(N+)(=O)(O))sc(c1c1ccc(cc1)Cl)C
InChI=1SC20H15ClN2O6Sc11117(123513(21)6412)18(20(25)282)19(3011)2215(24)971481016(2914)23(26)27h310H12H3(H2224)b97+
methyl4(4chlorophenyl)5methyl2(((2E)3(5nitrofuran2yl)prop2enoyl)amino)thiophene3carboxylate
METHYL4(4CHLOROPHENYL)5METHYL2(((E)3(5NITROFURAN2YL)PROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD03757746
ZINC000002761359
ZINC02761359
ZINC2761359
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