Vitas-M small molecule compound
4-methyl-3-{[(naphthalen-1-ylcarbonyl)carbamothioyl]amino}benzoic acid
Catalog ID
STK100677
SMILES S=C(Nc1cc(ccc1C)C(=O)O)NC(=O)c1cccc2c1cccc2
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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 C20H16N2O3S MW 364.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O3S/c1-12-9-10-14(19(24)25)11-17(12)21-20(26)22-18(23)16-8-4-6-13-5-2-3-7-15(13)16/h2-11H,1H3,(H,24,25)(H2,21,22,23,26)InChIKey
YHZJJINSSFDFQH-UHFFFAOYSA-NSynonyms
4METHYL3(((NAPHTHALEN1YLCARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
4METHYL3(NAPHTHALENE1CARBONYLCARBAMOTHIOYLAMINO)BENZOICACID
CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC=CC3=CC=CC=C32
InChI=1SC20H16N2O3Sc11291014(19(24)25)1117(12)2120(26)2218(23)1684613523715(13)16h211H1H3(H2425)(H221222326)
MFCD03243884
ZINC000001156364
ZINC1156364
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