Vitas-M small molecule compound
2-{[5-(1H-benzotriazol-1-ylmethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-hydroxyphenyl)methylidene]acetohydrazide
Catalog ID
STL171400
SMILES C=CCn1c(SCC(=O)N/N=C/c2cccc(c2)O)nnc1Cn1nnc2c1cccc2
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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 C21H20N8O2S MW 448.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N8O2S/c1-2-10-28-19(13-29-18-9-4-3-8-17(18)23-27-29)24-26-21(28)32-14-20(31)25-22-12-15-6-5-7-16(30)11-15/h2-9,11-12,30H,1,10,13-14H2,(H,25,31)/b22-12+InChIKey
UYVDVOIYTHLIHG-WSDLNYQXSA-NSynonyms
570417-86-62((5(1Hbenzotriazol1ylmethyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N((E)(3hydroxyphenyl)methylidene)acetohydrazide
2((5(BENZOTRIAZOL1YLMETHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N((E)(3HYDROXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
570417866
C=CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=CC=C2)O)CN3C4=CC=CC=C4N=N3
C=CCn1c(SCC(=O)NN=Cc2cccc(c2)O)nnc1Cn1nnc2c1cccc2
InChI=1SC21H20N8O2Sc12102819(132918943817(18)232729)242621(28)321420(31)2522121565716(30)1115h29111230H1101314H2(H2531)b2212+
MFCD01436694
ZINC000000695583
ZINC33335391
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