Vitas-M small molecule compound
{5-bromo-2-[(4-methylbenzyl)oxy]phenyl}(pyrrolidin-1-yl)methanethione
Catalog ID
STL376397
SMILES Brc1ccc(c(c1)C(=S)N1CCCC1)OCc1ccc(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 C19H20BrNOS MW 390.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNOS/c1-14-4-6-15(7-5-14)13-22-18-9-8-16(20)12-17(18)19(23)21-10-2-3-11-21/h4-9,12H,2-3,10-11,13H2,1H3InChIKey
KNXDWJUUVFCZDA-UHFFFAOYSA-NSynonyms
(5bromo2((4methylbenzyl)oxy)phenyl)(pyrrolidin1yl)methanethione
(5BROMO2((4METHYLPHENYL)METHOXY)PHENYL)PYRROLIDIN1YLMETHANETHIONE
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)Br)C(=S)N3CCCC3
InChI=1SC19H20BrNOSc1144615(7514)1322189816(20)1217(18)19(23)2110231121h4912H23101113H21H3
MFCD05998245
ZINC000001072592
ZINC01072592
ZINC1072592
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