Vitas-M small molecule compound
4-bromo-2-(piperidin-1-ylcarbonothioyl)phenyl 3-methylbenzoate
Catalog ID
STL382826
SMILES Brc1ccc(c(c1)C(=S)N1CCCCC1)OC(=O)c1cccc(c1)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 C20H20BrNO2S MW 418.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrNO2S/c1-14-6-5-7-15(12-14)20(23)24-18-9-8-16(21)13-17(18)19(25)22-10-3-2-4-11-22/h5-9,12-13H,2-4,10-11H2,1H3InChIKey
OJYKWLXNNHBEHH-UHFFFAOYSA-NSynonyms
(4BROMO2(PIPERIDINE1CARBOTHIOYL)PHENYL)3METHYLBENZOATE
3METHYLBENZOICACID4BROMO2(PIPERIDINE1CARBOTHIOYL)PHENYLESTER
4bromo2(piperidin1ylcarbonothioyl)phenyl3methylbenzoate
4BROMO2(PIPERIDYLTHIOXOMETHYL)PHENYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)Br)C(=S)N3CCCCC3
InChI=1SC20H20BrNO2Sc11465715(1214)20(23)24189816(21)1317(18)19(25)22103241122h591213H241011H21H3
MFCD01062311
ZINC000000866339
ZINC00866339
ZINC866339
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