Vitas-M small molecule compound

4-bromo-N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide

Catalog ID
STK027686
SMILES CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(cc1)Br

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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/c1-2-30-18-10-8-17(9-11-18)28-26-19-12-7-16(13-20(19)27-28)24-22(31)25-21(29)14-3-5-15(23)6-4-14/h3-13H,2H2,1H3,(H2,24,25,29,31)
InChIKey
XWOIBAOPQVHBRO-UHFFFAOYSA-N
Synonyms
347337-14-8
347337148
4bromoN((2(4ethoxyphenyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)benzamide
4BROMON((2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
4BROMON((2(4ETHOXYPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(C=C4)Br
CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(cc1)Br
InChI=1SC22H18BrN5O2Sc12301810817(91118)28261912716(1320(19)2728)2422(31)2521(29)143515(23)6414h313H2H21H3(H224252931)
MFCD02221573
N(4BROMOBENZOYL)N(2(4ETHOXYPHENYL)2H123BENZOTRIAZOL5YL)THIOUREA
STK027686
ZINC000000678077
ZINC00678077
ZINC678077

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Available files

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