Vitas-M small molecule compound

ethyl 5-{2-hydroxy-3-[(tetrahydrofuran-2-ylmethyl)amino]propoxy}-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate

Catalog ID
STK944905
SMILES CCOC(=O)c1c(C)n(c2c1cc(OCC(CNCC1CCCO1)O)cc2)c1ccc(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 C27H34N2O5 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O5/c1-4-32-27(31)26-19(3)29(20-9-7-18(2)8-10-20)25-12-11-22(14-24(25)26)34-17-21(30)15-28-16-23-6-5-13-33-23/h7-12,14,21,23,28,30H,4-6,13,15-17H2,1-3H3
InChIKey
WIOXTSFLNUUGEO-UHFFFAOYSA-N
Synonyms

5(2HYDROXY3(2OXOLANYLMETHYLAMINO)PROPOXY)2METHYL1(4METHYLPHENYL)3INDOLECARBOXYLICACIDETHYLESTEROXALICACID
5(2HYDROXY3(TETRAHYDROFURFURYLAMINO)PROPOXY)2METHYL1(PTOLYL)INDOLE3CARBOXYLICACIDETHYLESTEROXALICACID
CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(CNCC3CCCO3)O)C4=CC=C(C=C4)C)C
ETHANEDIOICACIDETHYL2METHYL1(4METHYLPHENYL)5(2OXIDANYL3(OXOLAN2YLMETHYLAMINO)PROPOXY)INDOLE3CARBOXYLATE
ETHYL5(2HYDROXY3((OXOLAN2YLMETHYL)AMINO)PROPOXY)2METHYL1(4METHYLPHENYL)INDOLE3CARBOXYLATE
ethyl5(2hydroxy3((tetrahydrofuran2ylmethyl)amino)propoxy)2methyl1(4methylphenyl)1Hindole3carboxylate
ETHYL5(2HYDROXY3(OXOLAN2YLMETHYLAMINO)PROPOXY)2METHYL1(4METHYLPHENYL)INDOLE3CARBOXYLATE
ETHYL5(2HYDROXY3(OXOLAN2YLMETHYLAMINO)PROPOXY)2METHYL1(4METHYLPHENYL)INDOLE3CARBOXYLATEOXALICACID
InChI=1SC27H34N2O5c143227(31)2619(3)29(209718(2)81020)25121122(1424(25)26)341721(30)1528162365133323h7121421232830H46131517H213H3
MFCD03644436
ZINC000009601955
ZINC000009601958

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Available files

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