Vitas-M small molecule compound

N-[4-(acetylamino)phenyl]-2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STL055301
SMILES O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1Cc1ccco1)c1ccccc1F

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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 C23H20FN5O3S MW 465.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN5O3S/c1-15(30)25-16-8-10-17(11-9-16)26-21(31)14-33-23-28-27-22(19-6-2-3-7-20(19)24)29(23)13-18-5-4-12-32-18/h2-12H,13-14H2,1H3,(H,25,30)(H,26,31)
InChIKey
LLAOLYJSXRWBPX-UHFFFAOYSA-N
Synonyms
848928-97-2
848928972
CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4F
InChI=1SC23H20FN5O3Sc115(30)251681017(11916)2621(31)143323282722(19623720(19)24)29(23)131854123218h212H1314H21H3(H2530)(H2631)
MFCD05678027
N(4(acetylamino)phenyl)2((5(2fluorophenyl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
N(4(ACETYLAMINO)PHENYL)2(5(2FLUOROPHENYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(4ACETAMIDOPHENYL)2((5(2FLUOROPHENYL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4ACETAMIDOPHENYL)2((5(2FLUOROPHENYL)4(FURAN2YLMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4acetamidophenyl)2((5(2fluorophenyl)4(furan2ylmethyl)4H124triazol3yl)thio)acetamide
ZINC000002444260
ZINC02444260
ZINC2444260

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.