Vitas-M small molecule compound

methyl 5-(diethylcarbamoyl)-2-{[(3,5-dimethoxyphenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK426755
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1cc(OC)cc(c1)OC)CC

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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 C21H26N2O6S MW 434.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O6S/c1-7-23(8-2)20(25)17-12(3)16(21(26)29-6)19(30-17)22-18(24)13-9-14(27-4)11-15(10-13)28-5/h9-11H,7-8H2,1-6H3,(H,22,24)
InChIKey
UMPQEFOTUDZBJG-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=CC(=C2)OC)OC)C(=O)OC)C
InChI=1SC21H26N2O6Sc1723(82)20(25)1712(3)16(21(26)296)19(3017)2218(24)13914(274)1115(1013)285h911H78H216H3(H2224)
METHYL5((DIETHYLAMINO)CARBONYL)2((35DIMETHOXYBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
methyl5(diethylcarbamoyl)2(((35dimethoxyphenyl)carbonyl)amino)4methylthiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)2((35DIMETHOXYBENZOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)2((35DIMETHOXYPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD01358963
ZINC000000997514
ZINC00997514
ZINC997514

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Available files

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