Vitas-M small molecule compound
2-methyl-3-{[4-(methylsulfanyl)benzyl]amino}benzoic acid
Catalog ID
STK328590
SMILES CSc1ccc(cc1)CNc1cccc(c1C)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/c1-11-14(16(18)19)4-3-5-15(11)17-10-12-6-8-13(20-2)9-7-12/h3-9,17H,10H2,1-2H3,(H,18,19)InChIKey
QIKGDYDBBIPRMO-UHFFFAOYSA-NSynonyms
2methyl3((4(methylsulfanyl)benzyl)amino)benzoicacid
2methyl3((4methylsulfanylphenyl)methylamino)benzoicacid
CC1=C(C=CC=C1NCC2=CC=C(C=C2)SC)C(=O)O
InChI=1SC16H17NO2Sc11114(16(18)19)43515(11)1710126813(202)9712h3917H10H212H3(H1819)
MFCD07612126
ZINC000016579216
ZINC16579216
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