Vitas-M small molecule compound
3-(4-methoxyphenyl)-6,6-dimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK771875
SMILES COc1ccc(cc1)c1n[nH]c2c1C(=O)CC(C2)(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 C16H18N2O2 MW 270.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O2/c1-16(2)8-12-14(13(19)9-16)15(18-17-12)10-4-6-11(20-3)7-5-10/h4-7H,8-9H2,1-3H3,(H,17,18)InChIKey
MDJWVWVIIJJUKE-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)66dimethyl1567tetrahydro4Hindazol4one
3(4METHOXYPHENYL)66DIMETHYL1H567TRIHYDROINDAZOL4ONE
3(4METHOXYPHENYL)66DIMETHYL57DIHYDRO1HINDAZOL4ONE
CC1(CC2=C(C(=O)C1)C(=NN2)C3=CC=C(C=C3)OC)C
COc1ccc(cc1)c1n(nH)c2c1C(=O)CC(C2)(C)C
InChI=1SC16H18N2O2c116(2)81214(13(19)916)15(181712)104611(203)7510h47H89H213H3(H1718)
MFCD03767746
ZINC000000090941
ZINC00090941
ZINC90941
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