Vitas-M small molecule compound
propan-2-yl 2,7,7-trimethyl-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK371881
SMILES CC(OC(=O)C1=C(C)NC2=C(C1c1cccnc1)C(=O)CC(C2)(C)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 C21H26N2O3 MW 354.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O3/c1-12(2)26-20(25)17-13(3)23-15-9-21(4,5)10-16(24)19(15)18(17)14-7-6-8-22-11-14/h6-8,11-12,18,23H,9-10H2,1-5H3InChIKey
DXQSTFWBDSBMTH-UHFFFAOYSA-NSynonyms
298706-80-6298706806
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CN=CC=C3)C(=O)OC(C)C
InChI=1SC21H26N2O3c112(2)2620(25)1713(3)2315921(45)1016(24)19(15)18(17)14768221114h6811121823H910H215H3
MFCD00619560
propan2yl277trimethyl5oxo4(pyridin3yl)145678hexahydroquinoline3carboxylate
propan2yl277trimethyl5oxo4pyridin3yl1468tetrahydroquinoline3carboxylate
ZINC000100495263
ZINC000100495265
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