Vitas-M small molecule compound

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK696996
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccccc1)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 C24H19FN4O3S MW 462.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19FN4O3S/c25-19-9-5-4-8-18(19)23-27-28-24(29(23)17-6-2-1-3-7-17)33-15-22(30)26-16-10-11-20-21(14-16)32-13-12-31-20/h1-11,14H,12-13,15H2,(H,26,30)
InChIKey
CSTDBAJJCLRCAI-UHFFFAOYSA-N
Synonyms
764690-85-9
764690859
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CC=C5F
InChI=1SC24H19FN4O3Sc2519954818(19)23272824(29(23)176213717)331522(30)261610112021(1416)3213123120h11114H121315H2(H2630)
MFCD06343082
N(23DIHYDRO14BENZODIOXIN6YL)2((5(2FLUOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(23dihydro14benzodioxin6yl)2((5(2fluorophenyl)4phenyl4H124triazol3yl)sulfanyl)acetamide
N(23dihydrobenzo(b)(14)dioxin6yl)2((5(2fluorophenyl)4phenyl4H124triazol3yl)thio)acetamide
N(2H3HBENZO(34E)14DIOXIN6YL)2(5(2FLUOROPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000002200814
ZINC02200814
ZINC2200814

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Available files

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