Vitas-M small molecule compound
N'-[(E)-(4-methylphenyl)methylidene]-2-{[5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK957839
SMILES C=CCn1c(SCC(=O)N/N=C/c2ccc(cc2)C)nnc1COc1ccccc1
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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 C22H23N5O2S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S/c1-3-13-27-20(15-29-19-7-5-4-6-8-19)24-26-22(27)30-16-21(28)25-23-14-18-11-9-17(2)10-12-18/h3-12,14H,1,13,15-16H2,2H3,(H,25,28)/b23-14+InChIKey
SPOHEWMWOZGZAN-OEAKJJBVSA-NSynonyms
570417-81-12((4ALLYL5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)N(4METHYLBENZYLIDENE)ACETOHYDRAZIDE
570417811
C=CCn1c(SCC(=O)NN=Cc2ccc(cc2)C)nnc1COc1ccccc1
CC1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2CC=C)COC3=CC=CC=C3
InChI=1SC22H23N5O2Sc13132720(1529197546819)242622(27)301621(28)2523141811917(2)101218h31214H1131516H22H3(H2528)b2314+
MFCD01436668
N((E)(4methylphenyl)methylidene)2((5(phenoxymethyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(4methylphenyl)methylideneamino)2((5(phenoxymethyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000001001412
ZINC33291253
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