Vitas-M small molecule compound
N-(5-chloro-2-methoxyphenyl)-2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STL365927
SMILES COc1ccc(cc1NC(=O)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccccc1)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 C20H22ClN5O4S2 MW 496.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN5O4S2/c1-25-18(12-26(32(3,28)29)15-7-5-4-6-8-15)23-24-20(25)31-13-19(27)22-16-11-14(21)9-10-17(16)30-2/h4-11H,12-13H2,1-3H3,(H,22,27)InChIKey
ZUEBJVZPQUCZRU-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)Cl)OC)CN(C3=CC=CC=C3)S(=O)(=O)C
InChI=1SC20H22ClN5O4S2c12518(1226(32(328)29)157546815)232420(25)311319(27)22161114(21)91017(16)302h411H1213H213H3(H2227)
MFCD14833967
N(5chloro2methoxyphenyl)2((4methyl5(((methylsulfonyl)(phenyl)amino)methyl)4H124triazol3yl)sulfanyl)acetamide
N(5chloro2methoxyphenyl)2((4methyl5((Nmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetamide
ZINC000015019718
ZINC15019718
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