Vitas-M small molecule compound

1-(3,4-dimethylphenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one

Catalog ID
STK332560
SMILES Cc1cc(ccc1C)n1nc(c2c1CC(C)(C)CC2=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 C18H22N2O MW 282.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N2O/c1-11-6-7-14(8-12(11)2)20-15-9-18(4,5)10-16(21)17(15)13(3)19-20/h6-8H,9-10H2,1-5H3
InChIKey
MMHAJGGDZFNXHO-UHFFFAOYSA-N
Synonyms

1(34dimethylphenyl)366trimethyl1567tetrahydro4Hindazol4one
1(34dimethylphenyl)366trimethyl57dihydroindazol4one
CC1=C(C=C(C=C1)N2C3=C(C(=N2)C)C(=O)CC(C3)(C)C)C
InChI=1SC18H22N2Oc1116714(812(11)2)2015918(45)1016(21)17(15)13(3)1920h68H910H215H3
MFCD09962768
ZINC000018195129
ZINC18195129

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Available files

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