Vitas-M small molecule compound
ethyl 2-{[({5-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STL168431
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc([nH]2)N/N=C/c2ccco2)sc2c1CCC2
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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 C19H20N6O4S2 MW 460.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O4S2/c1-2-28-17(27)15-12-6-3-7-13(12)31-16(15)21-14(26)10-30-19-22-18(24-25-19)23-20-9-11-5-4-8-29-11/h4-5,8-9H,2-3,6-7,10H2,1H3,(H,21,26)(H2,22,23,24,25)/b20-9+InChIKey
JDVOPCLPAFEUQT-AWQFTUOYSA-NSynonyms
724747-74-4724747744
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NNC(=N3)NN=CC4=CC=CO4
CCOC(=O)c1c(NC(=O)CSc2nnc((nH)2)NN=Cc2ccco2)sc2c1CCC2
ethyl2((((5((2E)2(furan2ylmethylidene)hydrazinyl)4H124triazol3yl)sulfanyl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2((2((5((2E)2(furan2ylmethylidene)hydrazinyl)1H124triazol3yl)sulfanyl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC19H20N6O4S2c122817(27)151263713(12)3116(15)2114(26)1030192218(242519)23209115482911h4589H236710H21H3(H2126)(H222232425)b209+
MFCD03347858
ZINC000020168357
ZINC35669385
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