Vitas-M small molecule compound
2,3-dimethoxy-6-[(E)-(2-{[(5-{[(4-methylphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]benzoic acid
Catalog ID
STL171219
SMILES COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)CNc1ccc(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 C28H28N6O5S MW 560.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O5S/c1-18-9-12-20(13-10-18)29-16-23-31-33-28(34(23)21-7-5-4-6-8-21)40-17-24(35)32-30-15-19-11-14-22(38-2)26(39-3)25(19)27(36)37/h4-15,29H,16-17H2,1-3H3,(H,32,35)(H,36,37)/b30-15+InChIKey
OGOSPUICILPJFD-FJEPWZHXSA-NSynonyms
23dimethoxy6((E)((2((5((4methylanilino)methyl)4phenyl124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)benzoicacid
23dimethoxy6((E)(2(((5(((4methylphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)benzoicacid
CC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=C(C(=C(C=C4)OC)OC)C(=O)O
COc1c(OC)ccc(c1C(=O)O)C=NNC(=O)CSc1nnc(n1c1ccccc1)CNc1ccc(cc1)C
InChI=1SC28H28N6O5Sc11891220(131018)291623313328(34(23)217546821)401724(35)32301519111422(382)26(393)25(19)27(36)37h41529H1617H213H3(H3235)(H3637)b3015+
MFCD01432505
ZINC000008396634
ZINC103248168
Check stock
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