Vitas-M small molecule compound
3-butan-2-yl 6-methyl 4-(3,4-dichlorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK405248
SMILES CCC(OC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)Cl)C(=O)C(C(C2)C)C(=O)OC)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 C24H27Cl2NO5 MW 480.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27Cl2NO5/c1-6-12(3)32-24(30)19-13(4)27-17-9-11(2)18(23(29)31-5)22(28)21(17)20(19)14-7-8-15(25)16(26)10-14/h7-8,10-12,18,20,27H,6,9H2,1-5H3InChIKey
ZZTRMSHAVDWZQF-UHFFFAOYSA-NSynonyms
3butan2yl6methyl4(34dichlorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Obutan2yl6Omethyl4(34dichlorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)Cl)Cl)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC24H27Cl2NO5c1612(3)3224(30)1913(4)2717911(2)18(23(29)315)22(28)21(17)20(19)147815(25)16(26)1014h781012182027H69H215H3
MFCD06651900
ZINC000035913034
ZINC000229940375
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