Vitas-M small molecule compound

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

Catalog ID
STK554121
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CC(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 C20H27N3O4 MW 373.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O4/c1-12-7-13(2)10-23(9-12)11-17(24)22-18-15-6-5-14(26-3)8-16(15)21-19(18)20(25)27-4/h5-6,8,12-13,21H,7,9-11H2,1-4H3,(H,22,24)
InChIKey
FPLJKUCACAUAKG-UHFFFAOYSA-N
Synonyms
840471-42-3
840471423
CC1CC(CN(C1)CC(=O)NC2=C(NC3=C2C=CC(=C3)OC)C(=O)OC)C
COC(=O)c1(nH)c2c(c1NC(=O)CN1CC(C)CC(C1)C)ccc(c2)OC
InChI=1SC20H27N3O4c112713(2)1023(912)1117(24)2218156514(263)816(15)2119(18)20(25)274h568121321H7911H214H3(H2224)
METHYL3((((3R5S)35DIMETHYLPIPERIDIN1YL)ACETYL)AMINO)6METHOXY1HINDOLE2CARBOXYLATE
METHYL3((((3S5S)35DIMETHYLPIPERIDIN1YL)ACETYL)AMINO)6METHOXY1HINDOLE2CARBOXYLATE
methyl3(((35dimethylpiperidin1yl)acetyl)amino)6methoxy1Hindole2carboxylate
METHYL3((2(35DIMETHYLPIPERIDIN1YL)ACETYL)AMINO)6METHOXY1HINDOLE2CARBOXYLATE
methyl3(2(35dimethylpiperidin1yl)acetamido)6methoxy1Hindole2carboxylate
MFCD04005243
ZINC000002260367
ZINC000002260369

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Available files

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