Vitas-M small molecule compound

ethyl 3-{[3-(4-carbamoylpiperidin-1-yl)propanoyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate

Catalog ID
STK552163
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)C(=O)N)cc(c(c2)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 C22H30N4O6 MW 446.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O6/c1-4-32-22(29)20-19(14-11-16(30-2)17(31-3)12-15(14)24-20)25-18(27)7-10-26-8-5-13(6-9-26)21(23)28/h11-13,24H,4-10H2,1-3H3,(H2,23,28)(H,25,27)
InChIKey
CXGONLLIEPBLBM-UHFFFAOYSA-N
Synonyms
836644-79-2
836644792
CCOC(=O)c1(nH)c2c(c1NC(=O)CCN1CCC(CC1)C(=O)N)cc(c(c2)OC)OC
CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CCN3CCC(CC3)C(=O)N
ethyl3((3(4carbamoylpiperidin1yl)propanoyl)amino)56dimethoxy1Hindole2carboxylate
ethyl3(3(4carbamoylpiperidin1yl)propanamido)56dimethoxy1Hindole2carboxylate
ETHYL3(3(4CARBAMOYLPIPERIDIN1YL)PROPANOYLAMINO)56DIMETHOXY1HINDOLE2CARBOXYLATE
InChI=1SC22H30N4O6c143222(29)2019(141116(302)17(313)1215(14)2420)2518(27)710268513(6926)21(23)28h111324H410H213H3(H22328)(H2527)
MFCD03691370
ZINC000082110997
ZINC82110997

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Available files

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