Vitas-M small molecule compound
methyl 4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK959482
SMILES CCn1cc(c(n1)C)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC
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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 C18H23N3O3 MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3/c1-5-21-9-12(10(2)20-21)16-15(18(23)24-4)11(3)19-13-7-6-8-14(22)17(13)16/h9,16,19H,5-8H2,1-4H3InChIKey
MLNPGAFNRQNWKQ-UHFFFAOYSA-NSynonyms
492425-34-0492425340
CCN1C=C(C(=N1)C)C2C3=C(CCCC3=O)NC(=C2C(=O)OC)C
InChI=1SC18H23N3O3c1521912(10(2)2021)1615(18(23)244)11(3)191376814(22)17(13)16h91619H58H214H3
methyl4(1ethyl3methyl1Hpyrazol4yl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(1ethyl3methylpyrazol4yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD02175189
ZINC000005728189
ZINC000005728195
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