Vitas-M small molecule compound
ethyl 2-({[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK913348
SMILES CCOC(=O)c1c(sc2c1CCC2)NC(=O)c1nn(ccc1=O)c1cccc(c1)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 C22H21N3O4S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4S/c1-3-29-22(28)18-15-8-5-9-17(15)30-21(18)23-20(27)19-16(26)10-11-25(24-19)14-7-4-6-13(2)12-14/h4,6-7,10-12H,3,5,8-9H2,1-2H3,(H,23,27)InChIKey
LPNPFLMOVUTGEJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=NN(C=CC3=O)C4=CC=CC(=C4)C
ethyl2(((1(3methylphenyl)4oxo14dihydropyridazin3yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((1(3methylphenyl)4oxopyridazine3carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC22H21N3O4Sc132922(28)181585917(15)3021(18)2320(27)1916(26)101125(2419)1474613(2)1214h4671012H3589H212H3(H2327)
MFCD07428302
ZINC000012062539
ZINC12062539
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