Vitas-M small molecule compound
2-[(5-{[(4-methoxyphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL175298
SMILES COc1ccc(cc1)NCc1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1cc(OC)c(c(c1)OC)OC
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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 C28H30N6O5S MW 562.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N6O5S/c1-36-22-12-10-20(11-13-22)29-17-25-31-33-28(34(25)21-8-6-5-7-9-21)40-18-26(35)32-30-16-19-14-23(37-2)27(39-4)24(15-19)38-3/h5-16,29H,17-18H2,1-4H3,(H,32,35)/b30-16+InChIKey
AQRJBDYVGPHRMM-OKCVXOCRSA-NSynonyms
445287-26-32((5(((4methoxyphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)N((E)(345trimethoxyphenyl)methylidene)acetohydrazide
2((5((4methoxyanilino)methyl)4phenyl124triazol3yl)sulfanyl)N((E)(345trimethoxyphenyl)methylideneamino)acetamide
445287263
COC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC(=C(C(=C4)OC)OC)OC
COc1ccc(cc1)NCc1nnc(n1c1ccccc1)SCC(=O)NN=Cc1cc(OC)c(c(c1)OC)OC
InChI=1SC28H30N6O5Sc13622121020(111322)291725313328(34(25)218657921)401826(35)323016191423(372)27(394)24(1519)383h51629H1718H214H3(H3235)b3016+
MFCD01614581
ZINC000097959772
ZINC100364071
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