Vitas-M small molecule compound
ethyl (2E)-3-(4-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}thiophen-2-yl)-2-cyanoprop-2-enoate
Catalog ID
STL435871
SMILES CCOC(=O)/C(=C/c1scc(c1)CSc1nnc(s1)N)/C#N
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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 C13H12N4O2S3 MW 352.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O2S3/c1-2-19-11(18)9(5-14)4-10-3-8(6-20-10)7-21-13-17-16-12(15)22-13/h3-4,6H,2,7H2,1H3,(H2,15,16)/b9-4+InChIKey
YODKDMTVUYXGFH-RUDMXATFSA-NSynonyms
CCOC(=O)C(=CC1=CC(=CS1)CSC2=NN=C(S2)N)C#N
CCOC(=O)C(=Cc1scc(c1)CSc1nnc(s1)N)C#N
ethyl(2E)3(4(((5amino134thiadiazol2yl)sulfanyl)methyl)thiophen2yl)2cyanoprop2enoate
ETHYL(2E)3(4((5AMINO(134THIADIAZOL2YLTHIO))METHYL)(2THIENYL))2CYANOPROP2ENOATE
ethyl(E)3(4((5amino134thiadiazol2yl)sulfanylmethyl)thiophen2yl)2cyanoprop2enoate
InChI=1SC13H12N4O2S3c121911(18)9(514)41038(62010)72113171612(15)2213h346H27H21H3(H21516)b94+
MFCD07048904
ZINC000008306826
ZINC08306826
ZINC8306826
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