Vitas-M small molecule compound
5-cyclohexyl-4-{[(E)-(3-phenoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL043536
SMILES S=c1[nH]nc(n1/N=C/c1cccc(c1)Oc1ccccc1)C1CCCCC1
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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 C21H22N4OS MW 378.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4OS/c27-21-24-23-20(17-9-3-1-4-10-17)25(21)22-15-16-8-7-13-19(14-16)26-18-11-5-2-6-12-18/h2,5-8,11-15,17H,1,3-4,9-10H2,(H,24,27)/b22-15+InChIKey
WFIRVKGWCKVHRG-PXLXIMEGSA-NSynonyms
488855-56-73CYCLOHEXYL4((E)(3PHENOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
488855567
5cyclohexyl4(((E)(3phenoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
InChI=1SC21H22N4OSc2721242320(1793141017)25(21)221516871319(1416)2618115261218h258111517H134910H2(H2427)b2215+
MFCD03813802
S=c1(nH)nc(n1N=Cc1cccc(c1)Oc1ccccc1)C1CCCCC1
ZINC000002700081
ZINC02700079
ZINC2700079
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