Vitas-M small molecule compound

methyl 2-{[(3,4-dimethylphenyl)carbonyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate

Catalog ID
STK316272
SMILES COC(=O)c1cc(sc1NC(=O)c1ccc(c(c1)C)C)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 C18H21NO3S MW 331.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO3S/c1-10(2)15-9-14(18(21)22-5)17(23-15)19-16(20)13-7-6-11(3)12(4)8-13/h6-10H,1-5H3,(H,19,20)
InChIKey
DWLIEVPOABZEMS-UHFFFAOYSA-N
Synonyms
444999-25-1
444999251
CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(S2)C(C)C)C(=O)OC)C
InChI=1SC18H21NO3Sc110(2)15914(18(21)225)17(2315)1916(20)137611(3)12(4)813h610H15H3(H1920)
methyl2(((34dimethylphenyl)carbonyl)amino)5(propan2yl)thiophene3carboxylate
METHYL2((34DIMETHYLBENZOYL)AMINO)5ISOPROPYLTHIOPHENE3CARBOXYLATE
METHYL2((34DIMETHYLBENZOYL)AMINO)5PROPAN2YLTHIOPHENE3CARBOXYLATE
MFCD02606411
ZINC000000370781
ZINC00370781
ZINC370781

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Available files

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