Vitas-M small molecule compound

benzyl 6-(4-ethylphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Catalog ID
STK405746
SMILES CCc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCc1ccccc1

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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 C25H25NO3 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO3/c1-3-17-9-11-19(12-10-17)20-13-21-23(22(27)14-20)16(2)24(26-21)25(28)29-15-18-7-5-4-6-8-18/h4-12,20,26H,3,13-15H2,1-2H3
InChIKey
RFHUFBQYMPQSNH-UHFFFAOYSA-N
Synonyms

benzyl6(4ethylphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
benzyl6(4ethylphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
CCC1=CC=C(C=C1)C2CC3=C(C(=C(N3)C(=O)OCC4=CC=CC=C4)C)C(=O)C2
InChI=1SC25H25NO3c131791119(121017)20132123(22(27)1420)16(2)24(2621)25(28)2915187546818h4122026H31315H212H3
MFCD06754338
PHENYLMETHYL6(4ETHYLPHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
ZINC000006819394
ZINC000006819395

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Available files

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