Vitas-M small molecule compound

ethyl 4-(2,5-dimethylphenyl)-2-{[(3-propoxyphenyl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK444158
SMILES CCCOc1cccc(c1)C(=O)Nc1scc(c1C(=O)OCC)c1cc(C)ccc1C

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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 C25H27NO4S MW 437.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO4S/c1-5-12-30-19-9-7-8-18(14-19)23(27)26-24-22(25(28)29-6-2)21(15-31-24)20-13-16(3)10-11-17(20)4/h7-11,13-15H,5-6,12H2,1-4H3,(H,26,27)
InChIKey
AHFXVPXWRQDLQZ-UHFFFAOYSA-N
Synonyms

CCCOC1=CC=CC(=C1)C(=O)NC2=C(C(=CS2)C3=C(C=CC(=C3)C)C)C(=O)OCC
ethyl4(25dimethylphenyl)2(((3propoxyphenyl)carbonyl)amino)thiophene3carboxylate
ETHYL4(25DIMETHYLPHENYL)2((3PROPOXYBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL4(25DIMETHYLPHENYL)2((3PROPOXYPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC25H27NO4Sc1512301997818(1419)23(27)262422(25(28)2962)21(153124)201316(3)101117(20)4h7111315H5612H214H3(H2627)
MFCD02055924
ZINC000002088380
ZINC02088380
ZINC2088380

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Available files

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