Vitas-M small molecule compound
3-butyl-2-(5-chloro-2-methoxyphenyl)-2,5,6,7-tetrahydro-4H-indazol-4-one
Catalog ID
STK681159
SMILES CCCCc1c2C(=O)CCCc2nn1c1cc(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 C18H21ClN2O2 MW 332.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN2O2/c1-3-4-7-14-18-13(6-5-8-16(18)22)20-21(14)15-11-12(19)9-10-17(15)23-2/h9-11H,3-8H2,1-2H3InChIKey
LWGXRCSTLWQJEB-UHFFFAOYSA-NSynonyms
3butyl2(5chloro2methoxyphenyl)2567tetrahydro4Hindazol4one
3BUTYL2(5CHLORO2METHOXYPHENYL)67DIHYDRO5HINDAZOL4ONE
CCCCC1=C2C(=NN1C3=C(C=CC(=C3)Cl)OC)CCCC2=O
InChI=1SC18H21ClN2O2c1347141813(65816(18)22)2021(14)151112(19)91017(15)232h911H38H212H3
MFCD03768331
ZINC000002492162
ZINC02492162
ZINC2492162
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