Vitas-M small molecule compound

4-(piperidin-1-ylcarbonothioyl)phenyl 3-methylbenzoate

Catalog ID
STL383893
SMILES Cc1cccc(c1)C(=O)Oc1ccc(cc1)C(=S)N1CCCCC1

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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 C20H21NO2S MW 339.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO2S/c1-15-6-5-7-17(14-15)20(22)23-18-10-8-16(9-11-18)19(24)21-12-3-2-4-13-21/h5-11,14H,2-4,12-13H2,1H3
InChIKey
RDVMOAUOEYXTNF-UHFFFAOYSA-N
Synonyms

(4(PIPERIDINE1CARBOTHIOYL)PHENYL)3METHYLBENZOATE
3METHYLBENZOICACID4(PIPERIDINE1CARBOTHIOYL)PHENYLESTER
4(piperidin1ylcarbonothioyl)phenyl3methylbenzoate
4(PIPERIDYLTHIOXOMETHYL)PHENYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=S)N3CCCCC3
InChI=1SC20H21NO2Sc11565717(1415)20(22)231810816(91118)19(24)21123241321h51114H241213H21H3
MFCD01062159
ZINC000000193156
ZINC00193156
ZINC193156

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Available files

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