Vitas-M small molecule compound
N-(3-bromophenyl)-2-{[4-ethyl-5-({[(4-methoxyphenyl)acetyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK218959
SMILES COc1ccc(cc1)CC(=O)NCc1nnc(n1CC)SCC(=O)Nc1cccc(c1)Br
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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 C22H24BrN5O3S MW 518.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrN5O3S/c1-3-28-19(13-24-20(29)11-15-7-9-18(31-2)10-8-15)26-27-22(28)32-14-21(30)25-17-6-4-5-16(23)12-17/h4-10,12H,3,11,13-14H2,1-2H3,(H,24,29)(H,25,30)InChIKey
JKRKQBKLOWLBFA-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)Br)CNC(=O)CC3=CC=C(C=C3)OC
InChI=1SC22H24BrN5O3Sc132819(132420(29)11157918(312)10815)262722(28)321421(30)251764516(23)1217h41012H3111314H212H3(H2429)(H2530)
MFCD06000532
N((5(2(3BROMOANILINO)2OXOETHYL)SULFANYL4ETHYL124TRIAZOL3YL)METHYL)2(4METHOXYPHENYL)ACETAMIDE
N(3BROMOPHENYL)2((4ETHYL5((((4METHOXYPHENYL)ACETYL)AMINO)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002868475
ZINC02868475
ZINC2868475
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