Vitas-M small molecule compound
ethyl 4-({[4-(2-methyl-1H-imidazol-1-yl)benzyl]carbamothioyl}amino)benzoate
Catalog ID
STK234688
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCc1ccc(cc1)n1ccnc1C
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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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-3-27-20(26)17-6-8-18(9-7-17)24-21(28)23-14-16-4-10-19(11-5-16)25-13-12-22-15(25)2/h4-13H,3,14H2,1-2H3,(H2,23,24,28)InChIKey
WDUWRUKWJPTZGY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)N3C=CN=C3C
ethyl4(((4(2methyl1Himidazol1yl)benzyl)carbamothioyl)amino)benzoate
ETHYL4((4(2METHYLIMIDAZOL1YL)PHENYL)METHYLCARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC21H22N4O2Sc132720(26)176818(9717)2421(28)23141641019(11516)2513122215(25)2h413H314H212H3(H2232428)
MFCD07657717
ZINC000004629720
ZINC04629720
ZINC4629720
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