Vitas-M small molecule compound
1-[6-hydroxy-4-(4-methoxyphenyl)-3,6-dimethyl-4,5,6,7-tetrahydro-3aH-indazol-5-yl]ethanone
Catalog ID
STL334244
SMILES COc1ccc(cc1)C1C2C(=NN=C2CC(C1C(=O)C)(C)O)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 C18H22N2O3 MW 314.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O3/c1-10-15-14(20-19-10)9-18(3,22)17(11(2)21)16(15)12-5-7-13(23-4)8-6-12/h5-8,15-17,22H,9H2,1-4H3InChIKey
HDMQMOKRQPHFHG-UHFFFAOYSA-NSynonyms
1005100-58-21(6HYDROXY4(4METHOXYPHENYL)36DIMETHYL3A457TETRAHYDROINDAZOL5YL)ETHANONE
1(6hydroxy4(4methoxyphenyl)36dimethyl4567tetrahydro3aHindazol5yl)ethanone
1005100582
CC1=NN=C2C1C(C(C(C2)(C)O)C(=O)C)C3=CC=C(C=C3)OC
InChI=1SC18H22N2O3c1101514(201910)918(322)17(11(2)21)16(15)125713(234)8612h58151722H9H214H3
MFCD02159543
ZINC000004111581
ZINC000239309020
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