Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-(5,6-dimethyl-1H-benzimidazol-1-yl)prop-2-en-1-one
Catalog ID
STK078495
SMILES Cc1cc2ncn(c2cc1C)C(=O)/C=C/c1ccc2c(c1)OCO2
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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 C19H16N2O3 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3/c1-12-7-15-16(8-13(12)2)21(10-20-15)19(22)6-4-14-3-5-17-18(9-14)24-11-23-17/h3-10H,11H2,1-2H3/b6-4+InChIKey
JHOPVIFFKJDXCJ-GQCTYLIASA-NSynonyms
349578-51-4(2E)3(13BENZODIOXOL5YL)1(56DIMETHYL1HBENZIMIDAZOL1YL)PROP2EN1ONE
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)1(56DIMETHYLBENZIMIDAZOLYL)PROP2EN1ONE
(E)3(13BENZODIOXOL5YL)1(56DIMETHYLBENZIMIDAZOL1YL)PROP2EN1ONE
(E)3(benzo(d)(13)dioxol5yl)1(56dimethyl1Hbenzo(d)imidazol1yl)prop2en1one
349578514
CC1=CC2=C(C=C1C)N(C=N2)C(=O)C=CC3=CC4=C(C=C3)OCO4
Cc1cc2ncn(c2cc1C)C(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC19H16N2O3c11271516(813(12)2)21(102015)19(22)6414351718(914)24112317h310H11H212H3b64+
MFCD02861480
STK078495
ZINC000004670443
ZINC04670443
ZINC4670443
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