Vitas-M small molecule compound
2-{[5-(2-fluorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STL057884
SMILES O=C(c1ccccc1)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 C21H16FN3O2S MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN3O2S/c22-18-11-5-4-10-17(18)20-23-24-21(25(20)13-16-9-6-12-27-16)28-14-19(26)15-7-2-1-3-8-15/h1-12H,13-14H2InChIKey
TUKKKTJABCKGBI-UHFFFAOYSA-NSynonyms
849017-41-02((5(2FLUOROPHENYL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(2fluorophenyl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)1phenylethanone
2((5(2fluorophenyl)4(furan2ylmethyl)4H124triazol3yl)thio)1phenylethanone
849017410
C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CC=C4F
InChI=1SC21H16FN3O2Sc221811541017(18)20232421(25(20)131696122716)281419(26)157213815h112H1314H2
MFCD05680803
ZINC000002452097
ZINC02452097
ZINC2452097
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