Vitas-M small molecule compound
2-chloro-1-[2,2,4-trimethyl-4-(4-methylphenyl)-3,4-dihydroquinolin-1(2H)-yl]ethanone
Catalog ID
STL169638
SMILES ClCC(=O)N1c2ccccc2C(CC1(C)C)(C)c1ccc(cc1)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 C21H24ClNO MW 341.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClNO/c1-15-9-11-16(12-10-15)21(4)14-20(2,3)23(19(24)13-22)18-8-6-5-7-17(18)21/h5-12H,13-14H2,1-4H3InChIKey
HKCKZBSPJCWXKK-UHFFFAOYSA-NSynonyms
2chloro1(224trimethyl4(4methylphenyl)34dihydroquinolin1(2H)yl)ethanone
2chloro1(224trimethyl4(4methylphenyl)3Hquinolin1yl)ethanone
CC1=CC=C(C=C1)C2(CC(N(C3=CC=CC=C32)C(=O)CCl)(C)C)C
InChI=1SC21H24ClNOc11591116(121015)21(4)1420(23)23(19(24)1322)18865717(18)21h512H1314H214H3
MFCD01171388
ZINC000002739855
ZINC000002739856
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