Vitas-M small molecule compound
(2E)-2-cyano-3-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK180913
SMILES N#C/C(=C\c1ccc2c(c1)n(C)c(=O)n2C)/C(=O)NCC1CCCO1
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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 C18H20N4O3 MW 340.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O3/c1-21-15-6-5-12(9-16(15)22(2)18(21)24)8-13(10-19)17(23)20-11-14-4-3-7-25-14/h5-6,8-9,14H,3-4,7,11H2,1-2H3,(H,20,23)/b13-8+InChIKey
HCYGKHQXSAGNCH-MDWZMJQESA-NSynonyms
444561-39-1(2E)2CYANO3(13DIMETHYL2OXO23DIHYDRO1HBENZIMIDAZOL5YL)N(TETRAHYDROFURAN2YLMETHYL)PROP2ENAMIDE
(2E)3(13DIMETHYL2OXO(3HYDROBENZIMIDAZOL5YL))2CYANON(OXOLAN2YLMETHYL)PROP2ENAMIDE
(E)2CYANO3(13DIMETHYL2OXOBENZIMIDAZOL5YL)N(OXOLAN2YLMETHYL)PROP2ENAMIDE
444561391
CN1C2=C(C=C(C=C2)C=C(C#N)C(=O)NCC3CCCO3)N(C1=O)C
InChI=1SC18H20N4O3c121156512(916(15)22(2)18(21)24)813(1019)17(23)2011144372514h568914H34711H212H3(H2023)b138+
MFCD03181767
ZINC000000037466
ZINC000000037468
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