Vitas-M small molecule compound
N-{[4-ethyl-5-({2-[(2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-3,4-dimethoxybenzamide
Catalog ID
STK353653
SMILES COc1cc(ccc1OC)C(=O)NCc1nnc(n1CC)SCC(=O)Nc1ccccc1OC
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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 C23H27N5O5S MW 485.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O5S/c1-5-28-20(13-24-22(30)15-10-11-18(32-3)19(12-15)33-4)26-27-23(28)34-14-21(29)25-16-8-6-7-9-17(16)31-2/h6-12H,5,13-14H2,1-4H3,(H,24,30)(H,25,29)InChIKey
OAGHTLLOXCECBJ-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2OC)CNC(=O)C3=CC(=C(C=C3)OC)OC
InChI=1SC23H27N5O5Sc152820(132422(30)15101118(323)19(1215)334)262723(28)341421(29)2516867917(16)312h612H51314H214H3(H2430)(H2529)
MFCD10466478
N((4ETHYL5((2((2METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
N((4ETHYL5(2(2METHOXYANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)34DIMETHOXYBENZAMIDE
ZINC000010039136
ZINC10039136
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