Vitas-M small molecule compound
2-amino-4-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL334759
SMILES N#CC1=C(N)OC2=C(C1c1cccn1c1ccc(cc1)[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 C20H16N4O4 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O4/c21-11-14-18(19-16(25)4-1-5-17(19)28-20(14)22)15-3-2-10-23(15)12-6-8-13(9-7-12)24(26)27/h2-3,6-10,18H,1,4-5,22H2InChIKey
HSFVCGWEJCFVTK-UHFFFAOYSA-NSynonyms
489440-39-32amino4(1(4nitrophenyl)1Hpyrrol2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(1(4nitrophenyl)pyrrol2yl)5oxo4678tetrahydrochromene3carbonitrile
489440393
C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=CN3C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C1
InChI=1SC20H16N4O4c21111418(1916(25)41517(19)2820(14)22)15321023(15)126813(9712)24(26)27h2361018H14522H2
MFCD03297100
N#CC1=C(N)OC2=C(C1c1cccn1c1ccc(cc1)(N+)(=O)(O))C(=O)CCC2
ZINC000001301258
ZINC000001301259
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