Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-benzyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)acetamide
Catalog ID
STL405960
SMILES O=C(Nc1ccc2c(c1)[nH]c(=O)[nH]2)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 C26H20N6O3S MW 496.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N6O3S/c33-23(27-18-10-11-19-20(13-18)29-25(34)28-19)15-36-26-31-30-24(32(26)14-16-6-2-1-3-7-16)22-12-17-8-4-5-9-21(17)35-22/h1-13H,14-15H2,(H,27,33)(H2,28,29,34)InChIKey
FLPMAPPETJXDGZ-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4benzyl124triazol3yl)sulfanyl)N(2oxo13dihydrobenzimidazol5yl)acetamide
2((5(1benzofuran2yl)4benzyl4H124triazol3yl)sulfanyl)N(2oxo23dihydro1Hbenzimidazol5yl)acetamide
C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)NC(=O)N4)C5=CC6=CC=CC=C6O5
InChI=1SC26H20N6O3Sc3323(271810111920(1318)2925(34)2819)153626313024(32(26)14166213716)221217845921(17)3522h113H1415H2(H2733)(H2282934)
MFCD27222531
O=C(Nc1ccc2c(c1)(nH)c(=O)(nH)2)CSc1nnc(n1Cc1ccccc1)c1cc2c(o1)cccc2
ZINC000020193776
ZINC20193776
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