Vitas-M small molecule compound
2-amino-5-oxo-1-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophen-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK778175
SMILES N#CC1=C(N)N(C2=C(C1c1cscc1)C(=O)CCC2)c1nnc(s1)SC(C)C
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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 C19H19N5OS3 MW 429.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5OS3/c1-10(2)27-19-23-22-18(28-19)24-13-4-3-5-14(25)16(13)15(11-6-7-26-9-11)12(8-20)17(24)21/h6-7,9-10,15H,3-5,21H2,1-2H3InChIKey
RUXREFAHNLRYIU-UHFFFAOYSA-NSynonyms
2amino5oxo1(5(propan2ylsulfanyl)134thiadiazol2yl)4(thiophen3yl)145678hexahydroquinoline3carbonitrile
2amino5oxo1(5propan2ylsulfanyl134thiadiazol2yl)4thiophen3yl4678tetrahydroquinoline3carbonitrile
CC(C)SC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CSC=C4)C(=O)CCC3
InChI=1SC19H19N5OS3c110(2)2719232218(2819)241343514(25)16(13)15(116726911)12(820)17(24)21h6791015H3521H212H3
MFCD05855883
ZINC000012401695
ZINC000012401696
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