Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL364374
SMILES CCn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1c1cc2c(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 C22H20N4O4S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S/c1-2-26-21(19-11-14-5-3-4-6-16(14)30-19)24-25-22(26)31-13-20(27)23-15-7-8-17-18(12-15)29-10-9-28-17/h3-8,11-12H,2,9-10,13H2,1H3,(H,23,27)InChIKey
JLMPEAQAMGHVTH-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCCO3)C4=CC5=CC=CC=C5O4
InChI=1SC22H20N4O4Sc122621(191114534616(14)3019)242522(26)311320(27)2315781718(1215)291092817h381112H291013H21H3(H2327)
MFCD09476166
ZINC000008784776
ZINC08784776
ZINC8784776
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