Vitas-M small molecule compound
2-amino-4-(5-nitrothiophen-2-yl)-5-oxo-1-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK784948
SMILES N#CC1=C(N)N(c2cccnc2)C2=C(C1c1ccc(s1)[N+](=O)[O-])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 C19H15N5O3S MW 393.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O3S/c20-9-12-17(15-6-7-16(28-15)24(26)27)18-13(4-1-5-14(18)25)23(19(12)21)11-3-2-8-22-10-11/h2-3,6-8,10,17H,1,4-5,21H2InChIKey
XAQBOKIAWQVXKH-UHFFFAOYSA-NSynonyms
2amino4(5nitrothiophen2yl)5oxo1(pyridin3yl)145678hexahydroquinoline3carbonitrile
2amino4(5nitrothiophen2yl)5oxo1pyridin3yl4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=CN=CC=C3)N)C#N)C4=CC=C(S4)(N+)(=O)(O))C(=O)C1
InChI=1SC19H15N5O3Sc2091217(156716(2815)24(26)27)1813(41514(18)25)23(19(12)21)11328221011h23681017H14521H2
MFCD07657380
N#CC1=C(N)N(c2cccnc2)C2=C(C1c1ccc(s1)(N+)(=O)(O))C(=O)CCC2
ZINC000004709686
ZINC000004709689
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