Vitas-M small molecule compound
2-{[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
Catalog ID
STL375411
SMILES COc1ccc(cc1)n1c(SCC(=O)N2CCOCC2)nnc1c1ccccc1
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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 C21H22N4O3S MW 410.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S/c1-27-18-9-7-17(8-10-18)25-20(16-5-3-2-4-6-16)22-23-21(25)29-15-19(26)24-11-13-28-14-12-24/h2-10H,11-15H2,1H3InChIKey
KSKYIHROUZYKDI-UHFFFAOYSA-NSynonyms
2((4(4METHOXYPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)1MORPHOLIN4YLETHANONE
2((4(4methoxyphenyl)5phenyl4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
2(4(4METHOXYPHENYL)5PHENYL(124TRIAZOL3YLTHIO))1MORPHOLIN4YLETHAN1ONE
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N3CCOCC3)C4=CC=CC=C4
InChI=1SC21H22N4O3Sc127189717(81018)2520(165324616)222321(25)291519(26)24111328141224h210H1115H21H3
MFCD02588958
ZINC000002838274
ZINC02838274
ZINC2838274
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