Vitas-M small molecule compound
1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-10-methyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Catalog ID
STK515762
SMILES N#Cc1cc2c(n(c1=O)c1nnc(s1)SCc1ccc(cc1)Cl)nc1n(c2=O)cccc1C
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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 C22H13ClN6O2S2 MW 492.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13ClN6O2S2/c1-12-3-2-8-28-17(12)25-18-16(20(28)31)9-14(10-24)19(30)29(18)21-26-27-22(33-21)32-11-13-4-6-15(23)7-5-13/h2-9H,11H2,1H3InChIKey
DZXIUAQDOCSERG-UHFFFAOYSA-NSynonyms
879925-68-51(5((4chlorobenzyl)sulfanyl)134thiadiazol2yl)10methyl25dioxo15dihydro2Hdipyrido(12a23d)pyrimidine3carbonitrile
1(5((4chlorophenyl)methylsulfanyl)134thiadiazol2yl)10methyl25dioxodipyrido(34c12f)pyrimidine3carbonitrile
879925685
CC1=CC=CN2C1=NC3=C(C2=O)C=C(C(=O)N3C4=NN=C(S4)SCC5=CC=C(C=C5)Cl)C#N
InChI=1SC22H13ClN6O2S2c1123282817(12)251816(20(28)31)914(1024)19(30)29(18)21262722(3321)3211134615(23)7513h29H11H21H3
MFCD06645352
ZINC000008611516
ZINC8611516
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