Vitas-M small molecule compound
4-methyl-3-[({[4-(propan-2-yl)phenyl]carbonyl}carbamothioyl)amino]benzoic acid
Catalog ID
STK103015
SMILES S=C(Nc1cc(ccc1C)C(=O)O)NC(=O)c1ccc(cc1)C(C)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 C19H20N2O3S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O3S/c1-11(2)13-6-8-14(9-7-13)17(22)21-19(25)20-16-10-15(18(23)24)5-4-12(16)3/h4-11H,1-3H3,(H,23,24)(H2,20,21,22,25)InChIKey
MKJIMEYCQDJTJO-UHFFFAOYSA-NSynonyms
433688-80-3433688803
4METHYL3((((4(PROPAN2YL)PHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
4METHYL3((4PROPAN2YLBENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
BENZOICACID4METHYL3((((4(1METHYLETHYL)BENZOYL)AMINO)THIOXOMETHYL)AMINO)
CC1=C(C=C(C=C1)C(=O)O)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C
InChI=1SC19H20N2O3Sc111(2)136814(9713)17(22)2119(25)20161015(18(23)24)5412(16)3h411H13H3(H2324)(H220212225)
MFCD03242334
ZINC000002998012
ZINC2998012
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