Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-benzyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Catalog ID
STL405956
SMILES O=C(Nc1nccs1)CSc1nnc(n1Cc1ccccc1)c1cc2c(o1)cccc2
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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 C22H17N5O2S2 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O2S2/c28-19(24-21-23-10-11-30-21)14-31-22-26-25-20(27(22)13-15-6-2-1-3-7-15)18-12-16-8-4-5-9-17(16)29-18/h1-12H,13-14H2,(H,23,24,28)InChIKey
DIGJHRHOLXCSRA-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4benzyl124triazol3yl)sulfanyl)N(13thiazol2yl)acetamide
2((5(1benzofuran2yl)4benzyl4H124triazol3yl)sulfanyl)N(13thiazol2yl)acetamide
C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=NC=CS3)C4=CC5=CC=CC=C5O4
InChI=1SC22H17N5O2S2c2819(24212310113021)143122262520(27(22)13156213715)181216845917(16)2918h112H1314H2(H232428)
MFCD27222543
ZINC000020193762
ZINC20193762
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