Vitas-M small molecule compound
2-amino-1-(3-nitrophenyl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK755213
SMILES N#CC1=C(N)N(c2cccc(c2)[N+](=O)[O-])C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CCC2
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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 C25H24N4O6 MW 476.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O6/c1-33-20-10-14(11-21(34-2)24(20)35-3)22-17(13-26)25(27)28(18-8-5-9-19(30)23(18)22)15-6-4-7-16(12-15)29(31)32/h4,6-7,10-12,22H,5,8-9,27H2,1-3H3InChIKey
DKUXYLZPWIBEEP-UHFFFAOYSA-NSynonyms
2amino1(3nitrophenyl)5oxo4(345trimethoxyphenyl)145678hexahydroquinoline3carbonitrile
2amino1(3nitrophenyl)5oxo4(345trimethoxyphenyl)4678tetrahydroquinoline3carbonitrile
COC1=CC(=CC(=C1OC)OC)C2C(=C(N(C3=C2C(=O)CCC3)C4=CC(=CC=C4)(N+)(=O)(O))N)C#N
InChI=1SC25H24N4O6c133201014(1121(342)24(20)353)2217(1326)25(27)28(1885919(30)23(18)22)1564716(1215)29(31)32h467101222H58927H213H3
MFCD00827502
N#CC1=C(N)N(c2cccc(c2)(N+)(=O)(O))C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CCC2
ZINC000000713544
ZINC000000713545
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