Vitas-M small molecule compound
3-butyl-1-(5-chloro-2-methoxyphenyl)-6,6-dimethyl-1,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK772261
SMILES CCCCc1nn(c2c1C(=O)CC(C2)(C)C)c1cc(Cl)ccc1OC
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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 C20H25ClN2O2 MW 360.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN2O2/c1-5-6-7-14-19-16(11-20(2,3)12-17(19)24)23(22-14)15-10-13(21)8-9-18(15)25-4/h8-10H,5-7,11-12H2,1-4H3InChIKey
DSRVJKRBCPAVJG-UHFFFAOYSA-NSynonyms
3butyl1(5chloro2methoxyphenyl)66dimethyl1567tetrahydro4Hindazol4one
3BUTYL1(5CHLORO2METHOXYPHENYL)66DIMETHYL57DIHYDROINDAZOL4ONE
CCCCC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=C(C=CC(=C3)Cl)OC
InChI=1SC20H25ClN2O2c1567141916(1120(23)1217(19)24)23(2214)151013(21)8918(15)254h810H571112H214H3
MFCD03768653
ZINC000003624975
ZINC03624975
ZINC3624975
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