Vitas-M small molecule compound
2-amino-1-(3-nitrophenyl)-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754180
SMILES N#CC1=C(N)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1cccc(c1)[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 C21H17N5O3 MW 387.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3/c22-11-16-19(13-4-3-9-24-12-13)20-17(7-2-8-18(20)27)25(21(16)23)14-5-1-6-15(10-14)26(28)29/h1,3-6,9-10,12,19H,2,7-8,23H2InChIKey
IVJNHABVTGQSGE-UHFFFAOYSA-NSynonyms
296771-35-2296771352
2amino1(3nitrophenyl)5oxo4(pyridin3yl)145678hexahydroquinoline3carbonitrile
2amino1(3nitrophenyl)5oxo4pyridin3yl4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=CC(=CC=C3)(N+)(=O)(O))N)C#N)C4=CN=CC=C4)C(=O)C1
InChI=1SC21H17N5O3c22111619(13439241213)2017(72818(20)27)25(21(16)23)1451615(1014)26(28)29h1369101219H27823H2
MFCD00825261
N#CC1=C(N)N(C2=C(C1c1cccnc1)C(=O)CCC2)c1cccc(c1)(N+)(=O)(O)
ZINC000000705425
ZINC000000705426
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