Vitas-M small molecule compound
1-{2-[(2-chloro-6-fluorobenzyl)sulfanyl]ethyl}-3-(3-chlorophenyl)urea
Catalog ID
STL087452
SMILES O=C(Nc1cccc(c1)Cl)NCCSCc1c(F)cccc1Cl
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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 C16H15Cl2FN2OS MW 373.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15Cl2FN2OS/c17-11-3-1-4-12(9-11)21-16(22)20-7-8-23-10-13-14(18)5-2-6-15(13)19/h1-6,9H,7-8,10H2,(H2,20,21,22)InChIKey
YYMMZBWKAFJGHA-UHFFFAOYSA-NSynonyms
1(2((2chloro6fluorobenzyl)sulfanyl)ethyl)3(3chlorophenyl)urea
1(2((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)ETHYL)3(3CHLOROPHENYL)UREA
C1=CC(=CC(=C1)Cl)NC(=O)NCCSCC2=C(C=CC=C2Cl)F
InChI=1SC16H15Cl2FN2OSc171131412(911)2116(22)207823101314(18)52615(13)19h169H7810H2(H2202122)
MFCD05837571
ZINC000002879859
ZINC02879859
ZINC2879859
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