Vitas-M small molecule compound
3-butyl-2-(5-chloro-2-methoxyphenyl)-6,6-dimethyl-2,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK772262
SMILES CCCCc1c2C(=O)CC(Cc2nn1c1cc(Cl)ccc1OC)(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 C20H25ClN2O2 MW 360.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN2O2/c1-5-6-7-15-19-14(11-20(2,3)12-17(19)24)22-23(15)16-10-13(21)8-9-18(16)25-4/h8-10H,5-7,11-12H2,1-4H3InChIKey
OAWRXCDMLWMVJB-UHFFFAOYSA-NSynonyms
3butyl2(5chloro2methoxyphenyl)66dimethyl2567tetrahydro4Hindazol4one
3BUTYL2(5CHLORO2METHOXYPHENYL)66DIMETHYL57DIHYDROINDAZOL4ONE
CCCCC1=C2C(=NN1C3=C(C=CC(=C3)Cl)OC)CC(CC2=O)(C)C
InChI=1SC20H25ClN2O2c1567151914(1120(23)1217(19)24)2223(15)161013(21)8918(16)254h810H571112H214H3
MFCD03768654
ZINC000003624977
ZINC03624977
ZINC3624977
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