Vitas-M small molecule compound
4,4'-(1,3-benzodioxol-5-ylmethanediyl)bis(3-methyl-1H-pyrazol-5-ol)
Catalog ID
STK060491
SMILES Cc1n[nH]c(c1C(c1c(O)[nH]nc1C)c1ccc2c(c1)OCO2)O
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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 C16H16N4O4 MW 328.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O4/c1-7-12(15(21)19-17-7)14(13-8(2)18-20-16(13)22)9-3-4-10-11(5-9)24-6-23-10/h3-5,14H,6H2,1-2H3,(H2,17,19,21)(H2,18,20,22)InChIKey
CFORPCGMFOJNAJ-UHFFFAOYSA-NSynonyms
432018-90-14(13BENZODIOXOL5YL(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
432018901
44(13BENZODIOXOL5YLMETHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
44(benzo(d)(13)dioxol5ylmethylene)bis(3methyl1Hpyrazol5ol)
CC1=C(C(=O)NN1)C(C2=CC3=C(C=C2)OCO3)C4=C(NNC4=O)C
Cc1n(nH)c(c1C(c1c(O)(nH)nc1C)c1ccc2c(c1)OCO2)O
InChI=1SC16H16N4O4c1712(15(21)19177)14(138(2)182016(13)22)9341011(59)2462310h3514H6H212H3(H2171921)(H2182022)
MFCD03016966
STK060491
ZINC000004095080
ZINC04095080
ZINC4095080
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