Vitas-M small molecule compound
N-[(6-chloro-2-phenyl-2H-benzotriazol-5-yl)carbamothioyl]-2-methoxy-3-methylbenzamide
Catalog ID
STK236969
SMILES COc1c(C)cccc1C(=O)NC(=S)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 C22H18ClN5O2S MW 451.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN5O2S/c1-13-7-6-10-15(20(13)30-2)21(29)25-22(31)24-17-12-19-18(11-16(17)23)26-28(27-19)14-8-4-3-5-9-14/h3-12H,1-2H3,(H2,24,25,29,31)InChIKey
DGHDQUKNWITWJP-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2Cl)C4=CC=CC=C4
InChI=1SC22H18ClN5O2Sc113761015(20(13)302)21(29)2522(31)2417121918(1116(17)23)2628(2719)148435914h312H12H3(H224252931)
MFCD03908712
N((6chloro2phenyl2Hbenzotriazol5yl)carbamothioyl)2methoxy3methylbenzamide
N((6CHLORO2PHENYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXY3METHYLBENZAMIDE
ZINC000001314025
ZINC01314025
ZINC1314025
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