Vitas-M small molecule compound
3-chloro-N-[(6-chloro-2-phenyl-2H-benzotriazol-5-yl)carbamothioyl]-4-methylbenzamide
Catalog ID
STK236968
SMILES S=C(NC(=O)c1ccc(c(c1)Cl)C)Nc1cc2nn(nc2cc1Cl)c1ccccc1
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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 C21H15Cl2N5OS MW 456.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N5OS/c1-12-7-8-13(9-15(12)22)20(29)25-21(30)24-17-11-19-18(10-16(17)23)26-28(27-19)14-5-3-2-4-6-14/h2-11H,1H3,(H2,24,25,29,30)InChIKey
HANJGEXHALTYJH-UHFFFAOYSA-NSynonyms
3chloroN((6chloro2phenyl2Hbenzotriazol5yl)carbamothioyl)4methylbenzamide
3CHLORON((6CHLORO2PHENYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHYLBENZAMIDE
CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2Cl)C4=CC=CC=C4)Cl
InChI=1SC21H15Cl2N5OSc1127813(915(12)22)20(29)2521(30)2417111918(1016(17)23)2628(2719)145324614h211H1H3(H224252930)
MFCD03908711
ZINC000009190429
ZINC09190429
ZINC9190429
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