Vitas-M small molecule compound
3-[({[3-(phenoxymethyl)phenyl]carbonyl}carbamothioyl)amino]benzoic acid
Catalog ID
STK008733
SMILES S=C(NC(=O)c1cccc(c1)COc1ccccc1)Nc1cccc(c1)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 C22H18N2O4S MW 406.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O4S/c25-20(24-22(29)23-18-9-5-8-17(13-18)21(26)27)16-7-4-6-15(12-16)14-28-19-10-2-1-3-11-19/h1-13H,14H2,(H,26,27)(H2,23,24,25,29)InChIKey
FGYGZHIWHQHLSW-UHFFFAOYSA-NSynonyms
532417-81-53((((3(PHENOXYMETHYL)PHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)BENZOICACID
3((3(PHENOXYMETHYL)BENZOYL)CARBAMOTHIOYLAMINO)BENZOICACID
532417815
BENZOICACID3((((3(PHENOXYMETHYL)BENZOYL)AMINO)THIOXOMETHYL)AMINO)
C1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)NC(=S)NC3=CC=CC(=C3)C(=O)O
InChI=1SC22H18N2O4Sc2520(2422(29)231895817(1318)21(26)27)1674615(1216)142819102131119h113H14H2(H2627)(H223242529)
MFCD03569806
S=C(NC(=O)c1cccc(c1)COc1ccccc1)Nc1cccc(c1)C(=O)O
STK008733
ZINC000004550889
ZINC4550889
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