Vitas-M small molecule compound

ethyl 1-[(1,2,2,4-tetramethyl-1,2,3,4-tetrahydroquinolin-6-yl)carbonothioyl]piperidine-4-carboxylate

Catalog ID
STL436289
SMILES CCOC(=O)C1CCN(CC1)C(=S)c1ccc2c(c1)C(C)CC(N2C)(C)C

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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 C22H32N2O2S MW 388.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32N2O2S/c1-6-26-21(25)16-9-11-24(12-10-16)20(27)17-7-8-19-18(13-17)15(2)14-22(3,4)23(19)5/h7-8,13,15-16H,6,9-12,14H2,1-5H3
InChIKey
KYKRLZYJYYSQPC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCN(CC1)C(=S)C2=CC3=C(C=C2)N(C(CC3C)(C)C)C
ethyl1((1224tetramethyl1234tetrahydroquinolin6yl)carbonothioyl)piperidine4carboxylate
ethyl1(1224tetramethyl34dihydroquinoline6carbothioyl)piperidine4carboxylate
InChI=1SC22H32N2O2Sc162621(25)1691124(121016)20(27)17781918(1317)15(2)1422(34)23(19)5h78131516H691214H215H3
MFCD30711931
ZINC000226074892
ZINC000226074904

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Available files

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