Vitas-M small molecule compound

2-methyl-3-({[(3-methylphenoxy)acetyl]carbamothioyl}amino)benzoic acid

Catalog ID
STK103438
SMILES O=C(NC(=S)Nc1cccc(c1C)C(=O)O)COc1cccc(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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-11-5-3-6-13(9-11)24-10-16(21)20-18(25)19-15-8-4-7-14(12(15)2)17(22)23/h3-9H,10H2,1-2H3,(H,22,23)(H2,19,20,21,25)
InChIKey
WGVYJLKVHMANRD-UHFFFAOYSA-N
Synonyms
434306-61-3
2METHYL3((((3METHYLPHENOXY)ACETYL)CARBAMOTHIOYL)AMINO)BENZOICACID
2METHYL3((2(3METHYLPHENOXY)ACETYL)CARBAMOTHIOYLAMINO)BENZOICACID
434306613
BENZOICACID2METHYL3(((((3METHYLPHENOXY)ACETYL)AMINO)THIOXOMETHYL)AMINO)
CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=CC=CC(=C2C)C(=O)O
InChI=1SC18H18N2O4Sc11153613(911)241016(21)2018(25)191584714(12(15)2)17(22)23h39H10H212H3(H2223)(H219202125)
MFCD03565783
ZINC000001159465
ZINC1159465

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Available files

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