Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[5-(1-benzofuran-2-yl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL365440
SMILES Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)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 C26H20N4O4S MW 484.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N4O4S/c1-16-6-9-19(10-7-16)30-25(23-12-17-4-2-3-5-20(17)34-23)28-29-26(30)35-14-24(31)27-18-8-11-21-22(13-18)33-15-32-21/h2-13H,14-15H2,1H3,(H,27,31)InChIKey
KIHYUFPYYYIIGB-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CC6=CC=CC=C6O5
InChI=1SC26H20N4O4Sc1166919(10716)3025(231217423520(17)3423)282926(30)351424(31)27188112122(1318)33153221h213H1415H21H3(H2731)
MFCD09476163
N(13benzodioxol5yl)2((5(1benzofuran2yl)4(4methylphenyl)124triazol3yl)sulfanyl)acetamide
N(13benzodioxol5yl)2((5(1benzofuran2yl)4(4methylphenyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000015018946
ZINC15018946
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