Vitas-M small molecule compound
4-({[1-(5-chloro-2-methylphenyl)-5-methyl-1H-1,2,3-triazol-4-yl]carbonyl}amino)phenyl thiocyanate
Catalog ID
STL017709
SMILES N#CSc1ccc(cc1)NC(=O)c1nnn(c1C)c1cc(Cl)ccc1C
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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 C18H14ClN5OS MW 383.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClN5OS/c1-11-3-4-13(19)9-16(11)24-12(2)17(22-23-24)18(25)21-14-5-7-15(8-6-14)26-10-20/h3-9H,1-2H3,(H,21,25)InChIKey
DMPOFELGDNDEHW-UHFFFAOYSA-NSynonyms
904815-15-2(1(5CHLORO2METHYLPHENYL)5METHYL(123TRIAZOL4YL))N(4CYANOTHIOPHENYL)CARBOXAMIDE
(4((1(5CHLORO2METHYLPHENYL)5METHYLTRIAZOLE4CARBONYL)AMINO)PHENYL)THIOCYANATE
1(5CHLORO2METHYLPHENYL)5METHYLN(4THIOCYANATOPHENYL)1H123TRIAZOLE4CARBOXAMIDE
4(((1(5chloro2methylphenyl)5methyl1H123triazol4yl)carbonyl)amino)phenylthiocyanate
904815152
CC1=C(C=C(C=C1)Cl)N2C(=C(N=N2)C(=O)NC3=CC=C(C=C3)SC#N)C
InChI=1SC18H14ClN5OSc1113413(19)916(11)2412(2)17(222324)18(25)21145715(8614)261020h39H12H3(H2125)
MFCD08543212
ZINC000008022146
ZINC08022146
ZINC8022146
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