Vitas-M small molecule compound
2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(2-methyl-5-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK761089
SMILES N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)(C)C)c1cc(ccc1C)[N+](=O)[O-]
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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 C27H28N4O5 MW 488.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O5/c1-15-6-8-17(31(33)34)11-19(15)30-20-12-27(2,3)13-21(32)25(20)24(18(14-28)26(30)29)16-7-9-22(35-4)23(10-16)36-5/h6-11,24H,12-13,29H2,1-5H3InChIKey
SSBRPIIBBIGPPB-UHFFFAOYSA-NSynonyms
2amino4(34dimethoxyphenyl)77dimethyl1(2methyl5nitrophenyl)5oxo145678hexahydroquinoline3carbonitrile
2AMINO4(34DIMETHOXYPHENYL)77DIMETHYL1(2METHYL5NITROPHENYL)5OXO68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C3=C(C(C(=C2N)C#N)C4=CC(=C(C=C4)OC)OC)C(=O)CC(C3)(C)C
InChI=1SC27H28N4O5c1156817(31(33)34)1119(15)30201227(23)1321(32)25(20)24(18(1428)26(30)29)167922(354)23(1016)365h61124H121329H215H3
MFCD01820537
N#CC1=C(N)N(C2=C(C1c1ccc(c(c1)OC)OC)C(=O)CC(C2)(C)C)c1cc(ccc1C)(N+)(=O)(O)
ZINC000001064877
ZINC000001064879
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Check stock on Vitas-MAvailable files
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