Vitas-M small molecule compound

methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-4-(3,4-dimethylphenyl)-5-methylthiophene-3-carboxylate

Catalog ID
STK451180
SMILES COC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)sc(c1c1ccc(c(c1)C)C)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 C23H21NO5S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO5S/c1-12-5-6-15(9-13(12)2)19-14(3)30-22(20(19)23(26)27-4)24-21(25)16-7-8-17-18(10-16)29-11-28-17/h5-10H,11H2,1-4H3,(H,24,25)
InChIKey
PQUZDRXQCVAMJV-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC4=C(C=C3)OCO4)C)C
InChI=1SC23H21NO5Sc1125615(913(12)2)1914(3)3022(20(19)23(26)274)2421(25)16781718(1016)29112817h510H11H214H3(H2425)
methyl2((13benzodioxol5ylcarbonyl)amino)4(34dimethylphenyl)5methylthiophene3carboxylate
METHYL2(13BENZODIOXOLE5CARBONYLAMINO)4(34DIMETHYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2(2HBENZO(34D)13DIOXOLAN5YLCARBONYLAMINO)4(34DIMETHYLPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
MFCD03073353
ZINC000002764027
ZINC02764027
ZINC2764027

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Available files

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