Vitas-M small molecule compound
1-(4-chlorophenyl)-3,6,6-trimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK326145
SMILES Clc1ccc(cc1)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 C16H17ClN2O MW 288.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN2O/c1-10-15-13(8-16(2,3)9-14(15)20)19(18-10)12-6-4-11(17)5-7-12/h4-7H,8-9H2,1-3H3InChIKey
SHHVTGNUGXUBKP-UHFFFAOYSA-NSynonyms
1(4chlorophenyl)366trimethyl1567tetrahydro4Hindazol4one
1(4chlorophenyl)366trimethyl57dihydroindazol4one
CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)Cl
InChI=1SC16H17ClN2Oc1101513(816(23)914(15)20)19(1810)126411(17)5712h47H89H213H3
MFCD08591891
ZINC000010338871
ZINC10338871
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