Vitas-M small molecule compound
dimethyl 2-{[(2E)-3-(2,4-dichlorophenyl)prop-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Catalog ID
STL332396
SMILES COC(=O)c1c(NC(=O)/C=C/c2ccc(cc2Cl)Cl)sc2c1C(CC2)C(=O)OC
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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 C20H17Cl2NO5S MW 454.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2NO5S/c1-27-19(25)12-6-7-14-16(12)17(20(26)28-2)18(29-14)23-15(24)8-4-10-3-5-11(21)9-13(10)22/h3-5,8-9,12H,6-7H2,1-2H3,(H,23,24)/b8-4+InChIKey
OVMXMDQRRZPVOB-XBXARRHUSA-NSynonyms
329223-85-0(E)DIMETHYL2(3(24DICHLOROPHENYL)ACRYLAMIDO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
329223850
COC(=O)c1c(NC(=O)C=Cc2ccc(cc2Cl)Cl)sc2c1C(CC2)C(=O)OC
COC(=O)C1CCC2=C1C(=C(S2)NC(=O)C=CC3=C(C=C(C=C3)Cl)Cl)C(=O)OC
dimethyl2(((2E)3(24dichlorophenyl)prop2enoyl)amino)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
DIMETHYL2(((E)3(24DICHLOROPHENYL)PROP2ENOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
InChI=1SC20H17Cl2NO5Sc12719(25)12671416(12)17(20(26)282)18(2914)2315(24)84103511(21)913(10)22h358912H67H212H3(H2324)b84+
METHYL2((2E)3(24DICHLOROPHENYL)PROP2ENOYLAMINO)3(METHOXYCARBONYL)456TRIHYDROCYCLOPENTA(32B)THIOPHENE4CARBOXYLATE
MFCD02338924
ZINC000000943850
ZINC000001744117
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