Vitas-M small molecule compound

methyl 4-({[2,2-bis(3-methylphenyl)cyclopropyl]carbonyl}amino)benzoate

Catalog ID
STK709957
SMILES COC(=O)c1ccc(cc1)NC(=O)C1CC1(c1cccc(c1)C)c1cccc(c1)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 C26H25NO3 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO3/c1-17-6-4-8-20(14-17)26(21-9-5-7-18(2)15-21)16-23(26)24(28)27-22-12-10-19(11-13-22)25(29)30-3/h4-15,23H,16H2,1-3H3,(H,27,28)
InChIKey
MOGOANHKVSRSRB-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1)C2(CC2C(=O)NC3=CC=C(C=C3)C(=O)OC)C4=CC(=CC=C4)C
InChI=1SC26H25NO3c11764820(1417)26(2195718(2)1521)1623(26)24(28)2722121019(111322)25(29)303h41523H16H213H3(H2728)
METHYL4((((1S)22BIS(3METHYLPHENYL)CYCLOPROPYL)CARBONYL)AMINO)BENZOATE
METHYL4(((22BIS(3METHYLPHENYL)CYCLOPROPYL)CARBONYL)AMINO)BENZOATE
METHYL4((22BIS(3METHYLPHENYL)CYCLOPROPANECARBONYL)AMINO)BENZOATE
MFCD01049283
ZINC000001436514
ZINC000001436515

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Available files

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