Vitas-M small molecule compound
ethyl (5Z)-5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL375013
SMILES CCOC(=O)C1=C(S/C(=C\c2ccc(o2)c2ccc(cc2)Cl)/C1=O)NC(=O)c1ccccc1
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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 C25H18ClNO5S MW 479.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClNO5S/c1-2-31-25(30)21-22(28)20(33-24(21)27-23(29)16-6-4-3-5-7-16)14-18-12-13-19(32-18)15-8-10-17(26)11-9-15/h3-14H,2H2,1H3,(H,27,29)/b20-14-InChIKey
PMVWSJIVJKHUMM-ZHZULCJRSA-NSynonyms
CCOC(=O)C1=C(SC(=CC2=CC=C(O2)C3=CC=C(C=C3)Cl)C1=O)NC(=O)C4=CC=CC=C4
CCOC(=O)C1=C(SC(=Cc2ccc(o2)c2ccc(cc2)Cl)C1=O)NC(=O)c1ccccc1
ETHYL(5Z)2BENZAMIDO5((5(4CHLOROPHENYL)FURAN2YL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5((5(4chlorophenyl)furan2yl)methylidene)4oxo2((phenylcarbonyl)amino)45dihydrothiophene3carboxylate
ETHYL2(BENZOYLAMINO)5((5(4CHLOROPHENYL)2FURYL)METHYLENE)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC25H18ClNO5Sc123125(30)2122(28)20(3324(21)2723(29)166435716)1418121319(3218)1581017(26)11915h314H2H21H3(H2729)b2014
MFCD03720186
ZINC000008396275
ZINC08396275
ZINC8396275
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