Vitas-M small molecule compound

methyl 3-{[3-(3,5-dimethylpiperidin-1-yl)propanoyl]amino}-6-methoxy-1H-indole-2-carboxylate

Catalog ID
STL346586
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CCN1CC(C)CC(C1)C)ccc(c2)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 C21H29N3O4 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O4/c1-13-9-14(2)12-24(11-13)8-7-18(25)23-19-16-6-5-15(27-3)10-17(16)22-20(19)21(26)28-4/h5-6,10,13-14,22H,7-9,11-12H2,1-4H3,(H,23,25)
InChIKey
XTUNKDLDEWYXCI-UHFFFAOYSA-N
Synonyms
848931-00-0
848931000
CC1CC(CN(C1)CCC(=O)NC2=C(NC3=C2C=CC(=C3)OC)C(=O)OC)C
COC(=O)c1(nH)c2c(c1NC(=O)CCN1CC(C)CC(C1)C)ccc(c2)OC
InChI=1SC21H29N3O4c113914(2)1224(1113)8718(25)2319166515(273)1017(16)2220(19)21(26)284h5610131422H791112H214H3(H2325)
METHYL3((3((3R5R)35DIMETHYLPIPERIDIN1YL)PROPANOYL)AMINO)6METHOXY1HINDOLE2CARBOXYLATE
METHYL3((3((3R5S)35DIMETHYLPIPERIDIN1YL)PROPANOYL)AMINO)6METHOXY1HINDOLE2CARBOXYLATE
methyl3((3(35dimethylpiperidin1yl)propanoyl)amino)6methoxy1Hindole2carboxylate
methyl3(3(35dimethylpiperidin1yl)propanamido)6methoxy1Hindole2carboxylate
METHYL3(3(35DIMETHYLPIPERIDIN1YL)PROPANOYLAMINO)6METHOXY1HINDOLE2CARBOXYLATE
MFCD05678242
ZINC000002444801
ZINC000002444803

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Available files

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