Vitas-M small molecule compound

5-bromo-2-chloro-N-{[2-(4-fluorophenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}benzamide

Catalog ID
STK236900
SMILES S=C(NC(=O)c1cc(Br)ccc1Cl)Nc1cc2nn(nc2cc1C)c1ccc(cc1)F

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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 C21H14BrClFN5OS MW 518.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrClFN5OS/c1-11-8-18-19(28-29(27-18)14-5-3-13(24)4-6-14)10-17(11)25-21(31)26-20(30)15-9-12(22)2-7-16(15)23/h2-10H,1H3,(H2,25,26,30,31)
InChIKey
WLDQGLXAMNWWSB-UHFFFAOYSA-N
Synonyms
637738-25-1
5bromo2chloroN((2(4fluorophenyl)6methyl2Hbenzo(d)(123)triazol5yl)carbamothioyl)benzamide
5bromo2chloroN((2(4fluorophenyl)6methyl2Hbenzotriazol5yl)carbamothioyl)benzamide
5BROMO2CHLORON((2(4FLUOROPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
637738251
CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl)C4=CC=C(C=C4)F
InChI=1SC21H14BrClFN5OSc11181819(2829(2718)145313(24)4614)1017(11)2521(31)2620(30)15912(22)2716(15)23h210H1H3(H225263031)
MFCD03674344
N(5BROMO2CHLOROBENZOYL)N(2(4FLUOROPHENYL)6METHYL2H123BENZOTRIAZOL5YL)THIOUREA
ZINC000002065626
ZINC02065626
ZINC2065626

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Available files

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