Vitas-M small molecule compound

ethyl 4-{[4-(2-methoxy-2-oxoethyl)phenyl]carbamothioyl}piperazine-1-carboxylate

Catalog ID
STK142800
SMILES CCOC(=O)N1CCN(CC1)C(=S)Nc1ccc(cc1)CC(=O)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 C17H23N3O4S MW 365.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O4S/c1-3-24-17(22)20-10-8-19(9-11-20)16(25)18-14-6-4-13(5-7-14)12-15(21)23-2/h4-7H,3,8-12H2,1-2H3,(H,18,25)
InChIKey
JLBJYTFPLZKSRT-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)C(=S)NC2=CC=C(C=C2)CC(=O)OC
ETHYL4((4(2METHOXY2OXOETHYL)PHENYL)CARBAMOTHIOYL)PIPERAZINE1CARBOXYLATE
InChI=1SC17H23N3O4Sc132417(22)2010819(91120)16(25)18146413(5714)1215(21)232h47H3812H212H3(H1825)
METHYL2(4(((4(ETHOXYCARBONYL)PIPERAZINYL)THIOXOMETHYL)AMINO)PHENYL)ACETATE
MFCD03760149
ZINC000004682492
ZINC04682492
ZINC4682492

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Available files

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