Vitas-M small molecule compound
2-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)-N-[3-(4-methoxyphenyl)-1H-1,2,4-triazol-5-yl]acetamide
Catalog ID
STK610914
SMILES COc1ccc(cc1)c1n[nH]c(n1)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl
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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 C21H17ClN4O5 MW 440.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN4O5/c1-10-13-7-15(22)16(27)9-17(13)31-20(29)14(10)8-18(28)23-21-24-19(25-26-21)11-3-5-12(30-2)6-4-11/h3-7,9,27H,8H2,1-2H3,(H2,23,24,25,26,28)InChIKey
ZITLGDFBEQNIIP-UHFFFAOYSA-NSynonyms
920434-98-62(6chloro7hydroxy4methyl2oxo2Hchromen3yl)N(3(4methoxyphenyl)1H124triazol5yl)acetamide
2(6chloro7hydroxy4methyl2oxochromen3yl)N(5(4methoxyphenyl)1H124triazol3yl)acetamide
920434986
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NC3=NNC(=N3)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1n(nH)c(n1)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl
InChI=1SC21H17ClN4O5c11013715(22)16(27)917(13)3120(29)14(10)818(28)23212419(252621)113512(302)6411h37927H8H212H3(H22324252628)
MFCD08746393
ZINC000009303811
ZINC9303811
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