Vitas-M small molecule compound

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

Catalog ID
STK527245
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)(C)C)cc(cc2)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/c1-5-28-20(26)19-18(15-11-14(27-4)7-8-16(15)22-19)23-17(25)12-24-10-6-9-21(2,3)13-24/h7-8,11,22H,5-6,9-10,12-13H2,1-4H3,(H,23,25)
InChIKey
JPCMGGNGXLUABG-UHFFFAOYSA-N
Synonyms

CCOC(=O)c1(nH)c2c(c1NC(=O)CN1CCCC(C1)(C)C)cc(cc2)OC
CCOC(=O)c1(nH)c2c(c1NC(=O)CN1CCCC(C1)(C)C)cc(cc2)OCCl
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CN3CCCC(C3)(C)C
ethyl3(((33dimethylpiperidin1yl)acetyl)amino)5methoxy1Hindole2carboxylate
ETHYL3((2(33DIMETHYLPIPERIDIN1YL)ACETYL)AMINO)5METHOXY1HINDOLE2CARBOXYLATE
ethyl3(2(33dimethylpiperidin1yl)acetamido)5methoxy1Hindole2carboxylatehydrochloride
InChI=1SC21H29N3O4c152820(26)1918(151114(274)7816(15)2219)2317(25)1224106921(23)1324h781122H569101213H214H3(H2325)
ZINC000002286079
ZINC2286079

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Available files

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