Vitas-M small molecule compound
3-[(5-chloro-2-methylphenyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Catalog ID
STK263728
SMILES O=C1C=C(CC(C1)(C)C)Nc1cc(Cl)ccc1C
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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 C15H18ClNO MW 263.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18ClNO/c1-10-4-5-11(16)6-14(10)17-12-7-13(18)9-15(2,3)8-12/h4-7,17H,8-9H2,1-3H3InChIKey
AEPJAPJIHUUOQZ-UHFFFAOYSA-NSynonyms
3((5chloro2methylphenyl)amino)55dimethylcyclohex2en1one
3(5CHLORO2METHYLANILINO)55DIMETHYL2CYCLOHEXEN1ONE
3(5CHLORO2METHYLANILINO)55DIMETHYLCYCLOHEX2EN1ONE
3(5CHLORO2METHYLPHENYLAMINO)55DIMETHYLCYCLOHEX2ENONE
CC1=C(C=C(C=C1)Cl)NC2=CC(=O)CC(C2)(C)C
InChI=1SC15H18ClNOc1104511(16)614(10)1712713(18)915(23)812h4717H89H213H3
MFCD00687031
ZINC000000276571
ZINC00276571
ZINC103614922
ZINC106523710
ZINC276571
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