Vitas-M small molecule compound
2-{[4-amino-5-(3-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-benzylacetamide
Catalog ID
STK987444
SMILES O=C(CSc1nnc(n1N)c1cccc(c1)F)NCc1ccccc1
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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 C17H16FN5OS MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN5OS/c18-14-8-4-7-13(9-14)16-21-22-17(23(16)19)25-11-15(24)20-10-12-5-2-1-3-6-12/h1-9H,10-11,19H2,(H,20,24)InChIKey
LBWUFMSMWDOJQW-UHFFFAOYSA-NSynonyms
2((4AMINO5(3FLUOROPHENYL)124TRIAZOL3YL)SULFANYL)NBENZYLACETAMIDE
2((4amino5(3fluorophenyl)4H124triazol3yl)sulfanyl)Nbenzylacetamide
C1=CC=C(C=C1)CNC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)F
InChI=1SC17H16FN5OSc181484713(914)16212217(23(16)19)251115(24)2010125213612h19H101119H2(H2024)
MFCD18184206
ZINC000004877209
ZINC04877209
ZINC4877209
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