Vitas-M small molecule compound
N'-[(E)-(2-chlorophenyl)methylidene]-2-{[5-{[(4-methylphenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK958139
SMILES C=CCn1c(SCC(=O)N/N=C/c2ccccc2Cl)nnc1CNc1ccc(cc1)C
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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 C22H23ClN6OS MW 454.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN6OS/c1-3-12-29-20(14-24-18-10-8-16(2)9-11-18)26-28-22(29)31-15-21(30)27-25-13-17-6-4-5-7-19(17)23/h3-11,13,24H,1,12,14-15H2,2H3,(H,27,30)/b25-13+InChIKey
XOHZEJOMADGNTB-DHRITJCHSA-NSynonyms
514218-72-5514218725
C=CCn1c(SCC(=O)NN=Cc2ccccc2Cl)nnc1CNc1ccc(cc1)C
CC1=CC=C(C=C1)NCC2=NN=C(N2CC=C)SCC(=O)NN=CC3=CC=CC=C3Cl
InChI=1SC22H23ClN6OSc13122920(14241810816(2)91118)262822(29)311521(30)27251317645719(17)23h3111324H1121415H22H3(H2730)b2513+
MFCD02371249
N((E)(2chlorophenyl)methylidene)2((5(((4methylphenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(2chlorophenyl)methylideneamino)2((5((4methylanilino)methyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000001001424
ZINC33291258
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