Vitas-M small molecule compound
N-{[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]carbamothioyl}-4-methylbenzamide
Catalog ID
STK080724
SMILES S=C(NC(=O)c1ccc(cc1)C)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)Cl
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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 C21H16ClN5OS MW 421.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN5OS/c1-13-2-4-14(5-3-13)20(28)24-21(29)23-16-8-11-18-19(12-16)26-27(25-18)17-9-6-15(22)7-10-17/h2-12H,1H3,(H2,23,24,28,29)InChIKey
XZUDZNIWDCCEBC-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)Cl
InChI=1SC21H16ClN5OSc1132414(5313)20(28)2421(29)23168111819(1216)2627(2518)179615(22)71017h212H1H3(H223242829)
MFCD02625317
N((2(4CHLOROPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHYLBENZAMIDE
N((2(4CHLOROPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHYLBENZAMIDE
S=C(NC(=O)c1ccc(cc1)C)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)Cl
STK080724
ZINC000013893047
ZINC13893047
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