Vitas-M small molecule compound

N'-[(E)-{3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-3-methylthiophene-2-carbohydrazide

Catalog ID
STK453396
SMILES COc1ccc(cc1Cn1nc(cc1C)C)/C=N/NC(=O)c1sccc1C

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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 C20H22N4O2S MW 382.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S/c1-13-7-8-27-19(13)20(25)22-21-11-16-5-6-18(26-4)17(10-16)12-24-15(3)9-14(2)23-24/h5-11H,12H2,1-4H3,(H,22,25)/b21-11+
InChIKey
VOOGXAIGGCDCBV-SRZZPIQSSA-N
Synonyms

CC1=C(SC=C1)C(=O)NN=CC2=CC(=C(C=C2)OC)CN3C(=CC(=N3)C)C
COc1ccc(cc1Cn1nc(cc1C)C)C=NNC(=O)c1sccc1C
InChI=1SC20H22N4O2Sc113782719(13)20(25)222111165618(264)17(1016)122415(3)914(2)2324h511H12H214H3(H2225)b2111+
MFCD02607724
N((1E)2(3((35DIMETHYLPYRAZOLYL)METHYL)4METHOXYPHENYL)1AZAVINYL)(3METHYL(2THIENYL))CARBOXAMIDE
N((E)(3((35dimethyl1Hpyrazol1yl)methyl)4methoxyphenyl)methylidene)3methylthiophene2carbohydrazide
N((E)(3((35DIMETHYLPYRAZOL1YL)METHYL)4METHOXYPHENYL)METHYLIDENEAMINO)3METHYLTHIOPHENE2CARBOXAMIDE
N(3((35DIMETHYL1HPYRAZOL1YL)METHYL)4METHOXYBENZYLIDENE)3METHYL2THIOPHENECARBOHYDRAZIDE
ZINC000000676289
ZINC33334105

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.