Vitas-M small molecule compound
2-(benzylsulfanyl)-N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-5-chloropyrimidine-4-carboxamide
Catalog ID
STK909945
SMILES O=C(c1nc(SCc2ccccc2)ncc1Cl)Nc1nnc(s1)SCc1ccccc1
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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 C21H16ClN5OS3 MW 486.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN5OS3/c22-16-11-23-19(29-12-14-7-3-1-4-8-14)24-17(16)18(28)25-20-26-27-21(31-20)30-13-15-9-5-2-6-10-15/h1-11H,12-13H2,(H,25,26,28)InChIKey
KRWSADDGEJPKCX-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)N(5(benzylsulfanyl)134thiadiazol2yl)5chloropyrimidine4carboxamide
2benzylsulfanylN(5benzylsulfanyl134thiadiazol2yl)5chloropyrimidine4carboxamide
C1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=NN=C(S3)SCC4=CC=CC=C4)Cl
InChI=1SC21H16ClN5OS3c2216112319(2912147314814)2417(16)18(28)2520262721(3120)30131595261015h111H1213H2(H252628)
MFCD06649069
ZINC000008868327
ZINC08868327
ZINC8868327
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