Vitas-M small molecule compound

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

Catalog ID
STK453916
SMILES COC(=O)c1c(NC(=O)c2cccc(c2)OC(C)C)sc(c1c1cc(C)ccc1C)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 C25H27NO4S MW 437.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO4S/c1-14(2)30-19-9-7-8-18(13-19)23(27)26-24-22(25(28)29-6)21(17(5)31-24)20-12-15(3)10-11-16(20)4/h7-14H,1-6H3,(H,26,27)
InChIKey
BMFNMUWFOPHFCH-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)C)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CC(=CC=C3)OC(C)C)C
InChI=1SC25H27NO4Sc114(2)301997818(1319)23(27)262422(25(28)296)21(17(5)3124)201215(3)101116(20)4h714H16H3(H2627)
methyl4(25dimethylphenyl)5methyl2(((3(propan2yloxy)phenyl)carbonyl)amino)thiophene3carboxylate
METHYL4(25DIMETHYLPHENYL)5METHYL2((3(METHYLETHOXY)PHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
methyl4(25dimethylphenyl)5methyl2((3propan2yloxybenzoyl)amino)thiophene3carboxylate
MFCD09779372
ZINC000020357324
ZINC20357324

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Available files

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