Vitas-M small molecule compound
(2E)-3-(3,5-dichloro-2-methoxyphenyl)-1-(2,4-dimethyl-4H-pyrazolo[1,5-a]benzimidazol-3-yl)prop-2-en-1-one
Catalog ID
STL006138
SMILES COc1c(/C=C/C(=O)c2c(C)nn3c2n(C)c2c3cccc2)cc(cc1Cl)Cl
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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 C21H17Cl2N3O2 MW 414.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17Cl2N3O2/c1-12-19(21-25(2)16-6-4-5-7-17(16)26(21)24-12)18(27)9-8-13-10-14(22)11-15(23)20(13)28-3/h4-11H,1-3H3/b9-8+InChIKey
UBMHXDUKEKESTB-CMDGGOBGSA-NSynonyms
573946-80-2(2E)3(35dichloro2methoxyphenyl)1(24dimethyl4Hpyrazolo(15a)benzimidazol3yl)prop2en1one
(E)3(35dichloro2methoxyphenyl)1(24dimethyl4Hbenzo(45)imidazo(12b)pyrazol3yl)prop2en1one
(E)3(35DICHLORO2METHOXYPHENYL)1(24DIMETHYLPYRAZOLO(15A)BENZIMIDAZOL3YL)PROP2EN1ONE
573946802
CC1=NN2C3=CC=CC=C3N(C2=C1C(=O)C=CC4=CC(=CC(=C4OC)Cl)Cl)C
COc1c(C=CC(=O)c2c(C)nn3c2n(C)c2c3cccc2)cc(cc1Cl)Cl
InChI=1SC21H17Cl2N3O2c11219(2125(2)16645717(16)26(21)2412)18(27)98131014(22)1115(23)20(13)283h411H13H3b98+
MFCD04021024
ZINC000005031576
ZINC05031576
ZINC5031576
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