Vitas-M small molecule compound
2-amino-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK776135
SMILES N#CC1=C(N)N(c2nnc(s2)SCc2ccccc2Cl)C2=C(C1c1cccnc1)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 C24H19ClN6OS2 MW 507.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN6OS2/c25-17-7-2-1-5-15(17)13-33-24-30-29-23(34-24)31-18-8-3-9-19(32)21(18)20(16(11-26)22(31)27)14-6-4-10-28-12-14/h1-2,4-7,10,12,20H,3,8-9,13,27H2InChIKey
FQEARZWSNZKDQW-UHFFFAOYSA-NSynonyms
2amino1(5((2chlorobenzyl)sulfanyl)134thiadiazol2yl)5oxo4(pyridin3yl)145678hexahydroquinoline3carbonitrile
2amino1(5((2chlorophenyl)methylsulfanyl)134thiadiazol2yl)5oxo4pyridin3yl4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=NN=C(S3)SCC4=CC=CC=C4Cl)N)C#N)C5=CN=CC=C5)C(=O)C1
InChI=1SC24H19ClN6OS2c2517721515(17)133324302923(3424)311883919(32)21(18)20(16(1126)22(31)27)146410281214h1247101220H3891327H2
MFCD05258548
ZINC000012375582
ZINC000012375583
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