Vitas-M small molecule compound

ethyl 4-{[(4-methylphenyl)sulfanyl]acetyl}piperazine-1-carboxylate

Catalog ID
STL221958
SMILES CCOC(=O)N1CCN(CC1)C(=O)CSc1ccc(cc1)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 C16H22N2O3S MW 322.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O3S/c1-3-21-16(20)18-10-8-17(9-11-18)15(19)12-22-14-6-4-13(2)5-7-14/h4-7H,3,8-12H2,1-2H3
InChIKey
FKODBKCEBXTVSJ-UHFFFAOYSA-N
Synonyms
358755-58-5
358755585
CCOC(=O)N1CCN(CC1)C(=O)CSC2=CC=C(C=C2)C
ethyl4(((4methylphenyl)sulfanyl)acetyl)piperazine1carboxylate
ETHYL4(2(4METHYLPHENYL)SULFANYLACETYL)PIPERAZINE1CARBOXYLATE
ETHYL4(2(PTOLYLTHIO)ACETYL)PIPERAZINE1CARBOXYLATE
InChI=1SC16H22N2O3Sc132116(20)1810817(91118)15(19)1222146413(2)5714h47H3812H212H3
MFCD01964668
ZINC000000616584
ZINC00616584
ZINC616584

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Available files

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