Vitas-M small molecule compound
4-{4-methoxy-3-[(2-nitrophenoxy)methyl]phenyl}-2-methyl-N-(3-methylpyridin-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL174249
SMILES COc1ccc(cc1COc1ccccc1[N+](=O)[O-])C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ncccc1C
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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 C31H30N4O6 MW 554.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O6/c1-18-8-7-15-32-30(18)34-31(37)27-19(2)33-22-9-6-11-24(36)29(22)28(27)20-13-14-25(40-3)21(16-20)17-41-26-12-5-4-10-23(26)35(38)39/h4-5,7-8,10,12-16,28,33H,6,9,11,17H2,1-3H3,(H,32,34,37)InChIKey
ZVZZWEGYWOLMQC-UHFFFAOYSA-NSynonyms
444932-59-64(4methoxy3((2nitrophenoxy)methyl)phenyl)2methylN(3methylpyridin2yl)5oxo145678hexahydroquinoline3carboxamide
4(4methoxy3((2nitrophenoxy)methyl)phenyl)2methylN(3methylpyridin2yl)5oxo4678tetrahydro1Hquinoline3carboxamide
444932596
CC1=C(N=CC=C1)NC(=O)C2=C(NC3=C(C2C4=CC(=C(C=C4)OC)COC5=CC=CC=C5(N+)(=O)(O))C(=O)CCC3)C
COc1ccc(cc1COc1ccccc1(N+)(=O)(O))C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)Nc1ncccc1C
InChI=1SC31H30N4O6c11887153230(18)3431(37)2719(2)3322961124(36)29(22)28(27)20131425(403)21(1620)17412612541023(26)35(38)39h45781012162833H691117H213H3(H323437)
MFCD02606792
ZINC000000673063
ZINC000018193451
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