Vitas-M small molecule compound
6-amino-3-tert-butyl-4-(4-chloro-1,3-benzodioxol-5-yl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK069887
SMILES N#CC1=C(N)Oc2c(C1c1ccc3c(c1Cl)OCO3)c([nH]n2)C(C)(C)C
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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 C18H17ClN4O3 MW 372.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN4O3/c1-18(2,3)15-12-11(9(6-20)16(21)26-17(12)23-22-15)8-4-5-10-14(13(8)19)25-7-24-10/h4-5,11H,7,21H2,1-3H3,(H,22,23)InChIKey
BGKWMPWHWCKMJN-UHFFFAOYSA-NSynonyms
354554-27-1354554271
6amino3(tertbutyl)4(4chlorobenzo(d)(13)dioxol5yl)24dihydropyrano(23c)pyrazole5carbonitrile
6AMINO3TERTBUTYL4(4CHLORO13BENZODIOXOL5YL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C4=C(C=C3)OCO4)Cl
InChI=1SC18H17ClN4O3c118(23)151211(9(620)16(21)2617(12)232215)8451014(13(8)19)2572410h4511H721H213H3(H2223)
MFCD01835799
N#CC1=C(N)Oc2c(C1c1ccc3c(c1Cl)OCO3)c((nH)n2)C(C)(C)C
STK069887
ZINC000004786155
ZINC000004786156
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