Vitas-M small molecule compound
2-(1H-benzimidazol-2-yl)-5-methyl-4-(3-methylbutyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK609350
SMILES CC(CCc1c(C)[nH]n(c1=O)c1nc2c([nH]1)cccc2)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 C16H20N4O MW 284.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O/c1-10(2)8-9-12-11(3)19-20(15(12)21)16-17-13-6-4-5-7-14(13)18-16/h4-7,10,19H,8-9H2,1-3H3,(H,17,18)InChIKey
HQVHCKOPNMAKEX-UHFFFAOYSA-NSynonyms
944780-01-22(1Hbenzimidazol2yl)5methyl4(3methylbutyl)12dihydro3Hpyrazol3one
2(1HBENZIMIDAZOL2YL)5METHYL4(3METHYLBUTYL)1HPYRAZOL3ONE
944780012
CC(CCc1c(C)(nH)n(c1=O)c1nc2c((nH)1)cccc2)C
CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3N2)CCC(C)C
InChI=1SC16H20N4Oc110(2)891211(3)1920(15(12)21)161713645714(13)1816h471019H89H213H3(H1718)
MFCD08735399
ZINC000002341135
ZINC02341135
ZINC100134610
ZINC2341135
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