Vitas-M small molecule compound
N-(3-cyanothiophen-2-yl)-2-{[5-(3,4-dichlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK472999
SMILES C=CCn1c(SCC(=O)Nc2sccc2C#N)nnc1c1ccc(c(c1)Cl)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 C18H13Cl2N5OS2 MW 450.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13Cl2N5OS2/c1-2-6-25-16(11-3-4-13(19)14(20)8-11)23-24-18(25)28-10-15(26)22-17-12(9-21)5-7-27-17/h2-5,7-8H,1,6,10H2,(H,22,26)InChIKey
LKAPRTGUDFYCSE-UHFFFAOYSA-NSynonyms
2(5(34DICHLOROPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(3CYANO(2THIENYL))ACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2=C(C=CS2)C#N)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC18H13Cl2N5OS2c1262516(113413(19)14(20)811)232418(25)281015(26)221712(921)572717h2578H1610H2(H2226)
MFCD07080474
N(3cyanothiophen2yl)2((5(34dichlorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(3cyanothiophen2yl)2((5(34dichlorophenyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000020161249
ZINC20161249
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