Vitas-M small molecule compound
ethyl 5-[(1H-benzimidazol-2-ylsulfanyl)methyl]-3-ethyl-2-oxotetrahydrofuran-3-carboxylate (non-preferred name)
Catalog ID
STK764612
SMILES CCOC(=O)C1(CC)CC(OC1=O)CSc1nc2c([nH]1)cccc2
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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 C17H20N2O4S MW 348.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S/c1-3-17(14(20)22-4-2)9-11(23-15(17)21)10-24-16-18-12-7-5-6-8-13(12)19-16/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,19)InChIKey
MAXUMEIVVUHYLR-UHFFFAOYSA-NSynonyms
CCC1(CC(OC1=O)CSC2=NC3=CC=CC=C3N2)C(=O)OCC
CCOC(=O)C1(CC)CC(OC1=O)CSc1nc2c((nH)1)cccc2
ethyl5(((1Hbenzo(d)imidazol2yl)thio)methyl)3ethyl2oxotetrahydrofuran3carboxylate
ethyl5((1Hbenzimidazol2ylsulfanyl)methyl)3ethyl2oxotetrahydrofuran3carboxylate(nonpreferredname)
ETHYL5(1HBENZIMIDAZOL2YLSULFANYLMETHYL)3ETHYL2OXOOXOLANE3CARBOXYLATE
ETHYL5(BENZIMIDAZOL2YLTHIOMETHYL)3ETHYL2OXO345TRIHYDROFURAN3CARBOXYLATE
InChI=1SC17H20N2O4Sc1317(14(20)2242)911(2315(17)21)1024161812756813(12)1916h5811H34910H212H3(H1819)
MFCD02043325
ZINC000000034336
ZINC000000034339
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