Vitas-M small molecule compound
4-methyl-3-{[4-(methylsulfanyl)benzyl]amino}benzoic acid
Catalog ID
STK511752
SMILES CSc1ccc(cc1)CNc1cc(ccc1C)C(=O)O
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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 C16H17NO2S MW 287.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO2S/c1-11-3-6-13(16(18)19)9-15(11)17-10-12-4-7-14(20-2)8-5-12/h3-9,17H,10H2,1-2H3,(H,18,19)InChIKey
OEDDXEIJYRUVJB-UHFFFAOYSA-NSynonyms
886624-04-04methyl3((4(methylsulfanyl)benzyl)amino)benzoicacid
4methyl3((4methylsulfanylphenyl)methylamino)benzoicacid
886624040
CC1=C(C=C(C=C1)C(=O)O)NCC2=CC=C(C=C2)SC
InChI=1SC16H17NO2Sc1113613(16(18)19)915(11)1710124714(202)8512h3917H10H212H3(H1819)
MFCD07612127
ZINC000016577430
ZINC16577430
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