Vitas-M small molecule compound
ethyl 3-(2-cyclohexylethyl)-6-(3,4-dimethoxyphenyl)-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK405729
SMILES CCOC(=O)c1[nH]c2c(c1CCC1CCCCC1)C(=O)CC(C2)c1ccc(c(c1)OC)OC
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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 C27H35NO5 MW 453.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35NO5/c1-4-33-27(30)26-20(12-10-17-8-6-5-7-9-17)25-21(28-26)14-19(15-22(25)29)18-11-13-23(31-2)24(16-18)32-3/h11,13,16-17,19,28H,4-10,12,14-15H2,1-3H3InChIKey
KSTWALWZSHVTII-UHFFFAOYSA-NSynonyms
CCOC(=O)c1(nH)c2c(c1CCC1CCCCC1)C(=O)CC(C2)c1ccc(c(c1)OC)OC
CCOC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC(=C(C=C3)OC)OC)CCC4CCCCC4
ethyl3(2cyclohexylethyl)6(34dimethoxyphenyl)4oxo1567tetrahydroindole2carboxylate
ethyl3(2cyclohexylethyl)6(34dimethoxyphenyl)4oxo4567tetrahydro1Hindole2carboxylate
ETHYL6(34DIMETHOXYPHENYL)3(2CYCLOHEXYLETHYL)4OXO567TRIHYDROINDOLE2CARBOXYLATE
InChI=1SC27H35NO5c143327(30)2620(1210178657917)2521(2826)1419(1522(25)29)18111323(312)24(1618)323h111316171928H410121415H213H3
MFCD06754322
ZINC000009559799
ZINC000009559800
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