Vitas-M small molecule compound
(2E)-1-(5,6-dimethyl-1H-benzimidazol-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK080214
SMILES COc1cc(/C=C/C(=O)n2cnc3c2cc(C)c(c3)C)cc(c1OC)OC
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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 C21H22N2O4 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4/c1-13-8-16-17(9-14(13)2)23(12-22-16)20(24)7-6-15-10-18(25-3)21(27-5)19(11-15)26-4/h6-12H,1-5H3/b7-6+InChIKey
IIAAWYWHKMWQRA-VOTSOKGWSA-NSynonyms
432511-69-8(2E)1(56DIMETHYL1HBENZIMIDAZOL1YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(2E)1(56DIMETHYLBENZIMIDAZOLYL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1(56DIMETHYLBENZIMIDAZOL1YL)3(345TRIMETHOXYPHENYL)PROP2EN1ONE
432511698
CC1=CC2=C(C=C1C)N(C=N2)C(=O)C=CC3=CC(=C(C(=C3)OC)OC)OC
COc1cc(C=CC(=O)n2cnc3c2cc(C)c(c3)C)cc(c1OC)OC
InChI=1SC21H22N2O4c11381617(914(13)2)23(122216)20(24)76151018(253)21(275)19(1115)264h612H15H3b76+
MFCD03348360
STK080214
ZINC000004671596
ZINC04671596
ZINC4671596
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