Vitas-M small molecule compound
3-[({[5-(furan-2-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoic acid
Catalog ID
STK328798
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C(=O)O)nnc1c1ccco1
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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 C22H18N4O5S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O5S/c1-30-17-9-7-16(8-10-17)26-20(18-6-3-11-31-18)24-25-22(26)32-13-19(27)23-15-5-2-4-14(12-15)21(28)29/h2-12H,13H2,1H3,(H,23,27)(H,28,29)InChIKey
OQFBBASXLBMLBT-UHFFFAOYSA-NSynonyms
728034-92-23((((5(furan2yl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
3((2((5(FURAN2YL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOICACID
3(2((5(furan2yl)4(4methoxyphenyl)4H124triazol3yl)thio)acetamido)benzoicacid
3(2(5FURAN2YL4(4METHOXYPHENYL)4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACID
728034922
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC(=C3)C(=O)O)C4=CC=CO4
InChI=1SC22H18N4O5Sc130179716(81017)2620(1863113118)242522(26)321319(27)231552414(1215)21(28)29h212H13H21H3(H2327)(H2829)
MFCD06017142
ZINC000002324292
ZINC2324292
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