Vitas-M small molecule compound
(2E)-3-(2-chlorophenyl)-N-{[4-ethyl-5-({2-[(3-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}prop-2-enamide
Catalog ID
STK118038
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1CC)CNC(=O)/C=C/c1ccccc1Cl
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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 C23H24ClN5O3S MW 485.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN5O3S/c1-3-29-20(14-25-21(30)12-11-16-7-4-5-10-19(16)24)27-28-23(29)33-15-22(31)26-17-8-6-9-18(13-17)32-2/h4-13H,3,14-15H2,1-2H3,(H,25,30)(H,26,31)/b12-11+InChIKey
QMSJVYAYRNDSEW-VAWYXSNFSA-NSynonyms
(2E)3(2CHLOROPHENYL)N((4ETHYL5((2((3METHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)PROP2ENAMIDE
(E)3(2CHLOROPHENYL)N((4ETHYL5(2(3METHOXYANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)PROP2ENAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)OC)CNC(=O)C=CC3=CC=CC=C3Cl
COc1cccc(c1)NC(=O)CSc1nnc(n1CC)CNC(=O)C=Cc1ccccc1Cl
InChI=1SC23H24ClN5O3Sc132920(142521(30)1211167451019(16)24)272823(29)331522(31)261786918(1317)322h413H31415H212H3(H2530)(H2631)b1211+
MFCD04128135
ZINC000009260499
ZINC09260499
ZINC9260499
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