Vitas-M small molecule compound
N-(3-bromophenyl)-2-{[5-(morpholin-4-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL381571
SMILES O=C(Nc1cccc(c1)Br)CSc1nnc(n1c1ccccc1)CN1CCOCC1
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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 C21H22BrN5O2S MW 488.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN5O2S/c22-16-5-4-6-17(13-16)23-20(28)15-30-21-25-24-19(14-26-9-11-29-12-10-26)27(21)18-7-2-1-3-8-18/h1-8,13H,9-12,14-15H2,(H,23,28)InChIKey
IMHAKPVHLYETPJ-UHFFFAOYSA-NSynonyms
C1COCCN1CC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NC4=CC(=CC=C4)Br
InChI=1SC21H22BrN5O2Sc221654617(1316)2320(28)153021252419(142691129121026)27(21)187213818h1813H9121415H2(H2328)
MFCD06627326
N(3BROMOPHENYL)2((5(MORPHOLIN4YLMETHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(3bromophenyl)2((5(morpholin4ylmethyl)4phenyl4H124triazol3yl)sulfanyl)acetamide
ZINC000019799386
ZINC19799386
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