Vitas-M small molecule compound
2-[2-(3,4-dimethoxybenzyl)-1H-benzimidazol-1-yl]-N'-{(E)-[3-methyl-1-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]methylidene}acetohydrazide
Catalog ID
STL037686
SMILES COc1cc(ccc1OC)Cc1nc2c(n1CC(=O)N/N=C/C1C(=NN(C1=O)c1ccc(cc1)C)C)cccc2
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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 C30H30N6O4 MW 538.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30N6O4/c1-19-9-12-22(13-10-19)36-30(38)23(20(2)34-36)17-31-33-29(37)18-35-25-8-6-5-7-24(25)32-28(35)16-21-11-14-26(39-3)27(15-21)40-4/h5-15,17,23H,16,18H2,1-4H3,(H,33,37)/b31-17+InChIKey
FOTNMKVUIDEPJF-KBVAKVRCSA-NSynonyms
2(2((34dimethoxyphenyl)methyl)benzimidazol1yl)N((E)(3methyl1(4methylphenyl)5oxo4Hpyrazol4yl)methylideneamino)acetamide
2(2(34dimethoxybenzyl)1Hbenzimidazol1yl)N((E)(3methyl1(4methylphenyl)5oxo45dihydro1Hpyrazol4yl)methylidene)acetohydrazide
CC1=CC=C(C=C1)N2C(=O)C(C(=N2)C)C=NNC(=O)CN3C4=CC=CC=C4N=C3CC5=CC(=C(C=C5)OC)OC
COc1cc(ccc1OC)Cc1nc2c(n1CC(=O)NN=CC1C(=NN(C1=O)c1ccc(cc1)C)C)cccc2
InChI=1SC30H30N6O4c11991222(131019)3630(38)23(20(2)3436)17313329(37)183525865724(25)3228(35)1621111426(393)27(1521)404h5151723H1618H214H3(H3337)b3117+
MFCD03811471
ZINC000001248404
ZINC000102858268
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