Vitas-M small molecule compound

ethyl 5-methoxy-3-{[3-(3-methylpiperidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate

Catalog ID
STL333227
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCCC(C1)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/c1-4-28-21(26)20-19(16-12-15(27-3)7-8-17(16)22-20)23-18(25)9-11-24-10-5-6-14(2)13-24/h7-8,12,14,22H,4-6,9-11,13H2,1-3H3,(H,23,25)
InChIKey
SKJQTRMXXCBOKD-UHFFFAOYSA-N
Synonyms
487032-38-2
487032382
CCOC(=O)c1(nH)c2c(c1NC(=O)CCN1CCCC(C1)C)cc(cc2)OC
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCCC(C3)C
ETHYL5METHOXY3((3((3R)3METHYLPIPERIDIN1YL)PROPANOYL)AMINO)1HINDOLE2CARBOXYLATE
ETHYL5METHOXY3((3((3S)3METHYLPIPERIDIN1YL)PROPANOYL)AMINO)1HINDOLE2CARBOXYLATE
ethyl5methoxy3((3(3methylpiperidin1yl)propanoyl)amino)1Hindole2carboxylate
ethyl5methoxy3(3(3methylpiperidin1yl)propanamido)1Hindole2carboxylate
ETHYL5METHOXY3(3(3METHYLPIPERIDIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
InChI=1SC21H29N3O4c142821(26)2019(161215(273)7817(16)2220)2318(25)91124105614(2)1324h78121422H4691113H213H3(H2325)
MFCD03287004
ZINC000002322077
ZINC000002322079

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Available files

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