Vitas-M small molecule compound
3-bromo-4-ethoxy-N-[(2-phenyl-2H-benzotriazol-5-yl)carbamothioyl]benzamide
Catalog ID
STL377471
SMILES CCOc1ccc(cc1Br)C(=O)NC(=S)Nc1ccc2c(c1)nn(n2)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 C22H18BrN5O2S MW 496.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN5O2S/c1-2-30-20-11-8-14(12-17(20)23)21(29)25-22(31)24-15-9-10-18-19(13-15)27-28(26-18)16-6-4-3-5-7-16/h3-13H,2H2,1H3,(H2,24,25,29,31)InChIKey
HWMJUXMTIPRNIW-UHFFFAOYSA-NSynonyms
3bromo4ethoxyN((2phenyl2Hbenzotriazol5yl)carbamothioyl)benzamide
3BROMO4ETHOXYN((2PHENYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC=C4)Br
InChI=1SC22H18BrN5O2Sc12302011814(1217(20)23)21(29)2522(31)24159101819(1315)2728(2618)166435716h313H2H21H3(H224252931)
MFCD02821029
ZINC000001171108
ZINC01171108
ZINC1171108
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