Vitas-M small molecule compound

N-benzyl-2-{[5-(4-ethyl-5-methylthiophen-3-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK469990
SMILES C=CCn1c(SCC(=O)NCc2ccccc2)nnc1c1csc(c1CC)C

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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 C21H24N4OS2 MW 412.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4OS2/c1-4-11-25-20(18-13-27-15(3)17(18)5-2)23-24-21(25)28-14-19(26)22-12-16-9-7-6-8-10-16/h4,6-10,13H,1,5,11-12,14H2,2-3H3,(H,22,26)
InChIKey
CCESAKODKVPGIM-UHFFFAOYSA-N
Synonyms

2(5(4ETHYL5METHYL(3THIENYL))4PROP2ENYL(124TRIAZOL3YLTHIO))NBENZYLACETAMIDE
CCC1=C(SC=C1C2=NN=C(N2CC=C)SCC(=O)NCC3=CC=CC=C3)C
InChI=1SC21H24N4OS2c14112520(18132715(3)17(18)52)232421(25)281419(26)22121697681016h461013H15111214H223H3(H2226)
MFCD06109220
Nbenzyl2((5(4ethyl5methylthiophen3yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
Nbenzyl2((5(4ethyl5methylthiophen3yl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000017089355
ZINC17089355

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Available files

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