Vitas-M small molecule compound
4-(2,4-dichlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK015406
SMILES N#CC1=C(C)NC2=C(C1c1ccc(cc1Cl)Cl)C(=O)CC(C2)(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 C19H18Cl2N2O MW 361.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2N2O/c1-10-13(9-22)17(12-5-4-11(20)6-14(12)21)18-15(23-10)7-19(2,3)8-16(18)24/h4-6,17,23H,7-8H2,1-3H3InChIKey
LBHROGPSOKHWBH-UHFFFAOYSA-NSynonyms
4(24dichlorophenyl)277trimethyl5oxo145678hexahydroquinoline3carbonitrile
4(24dichlorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carbonitrile
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(C=C(C=C3)Cl)Cl)C#N
InChI=1SC19H18Cl2N2Oc11013(922)17(125411(20)614(12)21)1815(2310)719(23)816(18)24h461723H78H213H3
MFCD00816371
N#CC1=C(C)NC2=C(C1c1ccc(cc1Cl)Cl)C(=O)CC(C2)(C)C
STK015406
ZINC000000628340
ZINC000000628350
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