Vitas-M small molecule compound
2-amino-1-(4-nitrophenyl)-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK753845
SMILES N#CC1=C(N)N(C2=C(C1c1cccs1)C(=O)CCC2)c1ccc(cc1)[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 C20H16N4O3S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N4O3S/c21-11-14-18(17-5-2-10-28-17)19-15(3-1-4-16(19)25)23(20(14)22)12-6-8-13(9-7-12)24(26)27/h2,5-10,18H,1,3-4,22H2InChIKey
XTJLTBRFFQTRSL-UHFFFAOYSA-NSynonyms
311330-85-52amino1(4nitrophenyl)5oxo4(thiophen2yl)145678hexahydroquinoline3carbonitrile
2amino1(4nitrophenyl)5oxo4thiophen2yl4678tetrahydroquinoline3carbonitrile
311330855
C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)(N+)(=O)(O))N)C#N)C4=CC=CS4)C(=O)C1
InChI=1SC20H16N4O3Sc21111418(1752102817)1915(31416(19)25)23(20(14)22)126813(9712)24(26)27h251018H13422H2
MFCD00824703
N#CC1=C(N)N(C2=C(C1c1cccs1)C(=O)CCC2)c1ccc(cc1)(N+)(=O)(O)
ZINC000004180886
ZINC000004180887
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