Vitas-M small molecule compound

tert-butyl 4-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}piperazine-1-carboxylate

Catalog ID
STL090122
SMILES O=C(Nc1ccc(c(c1)C)C)CN1CCN(CC1)C(=O)OC(C)(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 C19H29N3O3 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H29N3O3/c1-14-6-7-16(12-15(14)2)20-17(23)13-21-8-10-22(11-9-21)18(24)25-19(3,4)5/h6-7,12H,8-11,13H2,1-5H3,(H,20,23)
InChIKey
UAHKYSHQLJEMFS-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)OC(C)(C)C)C
InChI=1SC19H29N3O3c1146716(1215(14)2)2017(23)132181022(11921)18(24)2519(34)5h6712H81113H215H3(H2023)
MFCD18204437
tertbutyl4(2((34dimethylphenyl)amino)2oxoethyl)piperazine1carboxylate
tertbutyl4(2(34dimethylanilino)2oxoethyl)piperazine1carboxylate
ZINC000028937976
ZINC28937976

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Available files

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