Vitas-M small molecule compound
2-[(5-{[(4-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-phenylmethylidene]acetohydrazide
Catalog ID
STL171195
SMILES O=C(CSc1nnc(n1c1ccccc1)CNc1ccc(cc1)C)N/N=C/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 C25H24N6OS MW 456.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6OS/c1-19-12-14-21(15-13-19)26-17-23-28-30-25(31(23)22-10-6-3-7-11-22)33-18-24(32)29-27-16-20-8-4-2-5-9-20/h2-16,26H,17-18H2,1H3,(H,29,32)/b27-16+InChIKey
VMDUIAGKGXKEFF-JVWAILMASA-NSynonyms
2((5(((4methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)N((E)phenylmethylidene)acetohydrazide
CC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC=CC=C4
InChI=1SC25H24N6OSc119121421(151319)261723283025(31(23)22106371122)331824(32)292716208425920h21626H1718H21H3(H2932)b2716+
MFCD01432310
N((E)BENZYLIDENEAMINO)2((5((4METHYLANILINO)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
O=C(CSc1nnc(n1c1ccccc1)CNc1ccc(cc1)C)NN=Cc1ccccc1
ZINC000000695283
ZINC33335364
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