Vitas-M small molecule compound
4-methylbenzyl 6-(4-ethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK405792
SMILES CCOc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCc1ccc(cc1)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 C26H27NO4 MW 417.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO4/c1-4-30-21-11-9-19(10-12-21)20-13-22-24(23(28)14-20)17(3)25(27-22)26(29)31-15-18-7-5-16(2)6-8-18/h5-12,20,27H,4,13-15H2,1-3H3InChIKey
YJCMTGQSDPCKAG-UHFFFAOYSA-NSynonyms
(4methylphenyl)methyl6(4ethoxyphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
(4METHYLPHENYL)METHYL6(4ETHOXYPHENYL)3METHYL4OXO567TRIHYDROINDOLE2CARBOXYLATE
4methylbenzyl6(4ethoxyphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
CCOC1=CC=C(C=C1)C2CC3=C(C(=C(N3)C(=O)OCC4=CC=C(C=C4)C)C)C(=O)C2
CCOc1ccc(cc1)C1CC(=O)c2c(C1)(nH)c(c2C)C(=O)OCc1ccc(cc1)C
InChI=1SC26H27NO4c14302111919(101221)20132224(23(28)1420)17(3)25(2722)26(29)3115187516(2)6818h5122027H41315H213H3
MFCD06754382
ZINC000004912257
ZINC000004912261
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