Vitas-M small molecule compound
2-amino-5-oxo-1-[5-(propan-2-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK778488
SMILES N#CC1=C(N)N(C2=C(C1c1cccs1)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)24-12-5-3-6-13(25)16(12)15(11(9-20)17(24)21)14-7-4-8-26-14/h4,7-8,10,15H,3,5-6,21H2,1-2H3InChIKey
CJGNMGSTOYBJSB-UHFFFAOYSA-NSynonyms
2amino5oxo1(5(propan2ylsulfanyl)134thiadiazol2yl)4(thiophen2yl)145678hexahydroquinoline3carbonitrile
2amino5oxo1(5propan2ylsulfanyl134thiadiazol2yl)4thiophen2yl4678tetrahydroquinoline3carbonitrile
CC(C)SC1=NN=C(S1)N2C3=C(C(C(=C2N)C#N)C4=CC=CS4)C(=O)CCC3
InChI=1SC19H19N5OS3c110(2)2719232218(2819)241253613(25)16(12)15(11(920)17(24)21)147482614h4781015H35621H212H3
MFCD05856699
ZINC000012401691
ZINC000012401692
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