Vitas-M small molecule compound

ethyl 6-(4-ethoxyphenyl)-3-[2-(3-methoxyphenyl)ethyl]-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Catalog ID
STK405844
SMILES CCOC(=O)c1[nH]c2c(c1CCc1cccc(c1)OC)C(=O)CC(C2)c1ccc(cc1)OCC

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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 C28H31NO5 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO5/c1-4-33-21-12-10-19(11-13-21)20-16-24-26(25(30)17-20)23(27(29-24)28(31)34-5-2)14-9-18-7-6-8-22(15-18)32-3/h6-8,10-13,15,20,29H,4-5,9,14,16-17H2,1-3H3
InChIKey
ZEHMHMDTFUWMSU-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)c2c(c1CCc1cccc(c1)OC)C(=O)CC(C2)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)C2CC3=C(C(=O)C2)C(=C(N3)C(=O)OCC)CCC4=CC(=CC=C4)OC
ethyl6(4ethoxyphenyl)3(2(3methoxyphenyl)ethyl)4oxo1567tetrahydroindole2carboxylate
ethyl6(4ethoxyphenyl)3(2(3methoxyphenyl)ethyl)4oxo4567tetrahydro1Hindole2carboxylate
ETHYL6(4ETHOXYPHENYL)3(2(3METHOXYPHENYL)ETHYL)4OXO567TRIHYDROINDOLE2CARBOXYLATE
InChI=1SC28H31NO5c143321121019(111321)20162426(25(30)1720)23(27(2924)28(31)3452)1491876822(1518)323h681013152029H459141617H213H3
MFCD06754675
ZINC000009559845
ZINC000009559846

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Available files

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