Vitas-M small molecule compound
3-bromo-N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK018554
SMILES CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1cccc(c1)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/c1-2-30-18-9-7-17(8-10-18)28-26-19-11-6-16(13-20(19)27-28)24-22(31)25-21(29)14-4-3-5-15(23)12-14/h3-13H,2H2,1H3,(H2,24,25,29,31)InChIKey
JRWBIGBSDJCBEQ-UHFFFAOYSA-NSynonyms
425682-37-73bromoN((2(4ethoxyphenyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)benzamide
3BROMON((2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
3BROMON((2(4ETHOXYPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
425682377
CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=CC=C4)Br
CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1cccc(c1)Br
InChI=1SC22H18BrN5O2Sc1230189717(81018)28261911616(1320(19)2728)2422(31)2521(29)1443515(23)1214h313H2H21H3(H224252931)
MFCD02918007
STK018554
ZINC000001170003
ZINC01170003
ZINC1170003
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