Vitas-M small molecule compound
N-(4-methoxyphenyl)-5-methyl-1-(2-{[3-(methylsulfanyl)phenyl]amino}-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL129686
SMILES COc1ccc(cc1)NC(=O)c1nnn(c1C)CC(=O)Nc1cccc(c1)SC
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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 C20H21N5O3S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O3S/c1-13-19(20(27)22-14-7-9-16(28-2)10-8-14)23-24-25(13)12-18(26)21-15-5-4-6-17(11-15)29-3/h4-11H,12H2,1-3H3,(H,21,26)(H,22,27)InChIKey
XPBBDVGQICSZPU-UHFFFAOYSA-NSynonyms
CC1=C(N=NN1CC(=O)NC2=CC(=CC=C2)SC)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC20H21N5O3Sc11319(20(27)22147916(282)10814)232425(13)1218(26)211554617(1115)293h411H12H213H3(H2126)(H2227)
MFCD20747640
N(4methoxyphenyl)5methyl1(2((3(methylsulfanyl)phenyl)amino)2oxoethyl)1H123triazole4carboxamide
N(4methoxyphenyl)5methyl1(2(3methylsulfanylanilino)2oxoethyl)triazole4carboxamide
ZINC000067322634
ZINC67322634
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Check stock on Vitas-MAvailable files
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