Vitas-M small molecule compound
3-chloro-4-methoxy-N-{[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Catalog ID
STL388123
SMILES COc1ccc(cc1Cl)C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccncc1
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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 C21H15ClN4O3S MW 438.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClN4O3S/c1-28-17-4-2-13(10-15(17)22)19(27)26-21(30)24-14-3-5-18-16(11-14)25-20(29-18)12-6-8-23-9-7-12/h2-11H,1H3,(H2,24,26,27,30)InChIKey
PTNWEDRSXXTHHS-UHFFFAOYSA-NSynonyms
3chloro4methoxyN((2(pyridin4yl)13benzoxazol5yl)carbamothioyl)benzamide
3chloro4methoxyN((2pyridin4yl13benzoxazol5yl)carbamothioyl)benzamide
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC=NC=C4)Cl
InChI=1SC21H15ClN4O3Sc128174213(1015(17)22)19(27)2621(30)2414351816(1114)2520(2918)1268239712h211H1H3(H224262730)
MFCD02810696
ZINC000059438530
ZINC59438530
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