Vitas-M small molecule compound

2-{[5-(3-chlorophenyl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-fluorophenyl)ethanone

Catalog ID
STK598086
SMILES Fc1ccc(cc1)C(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

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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 C21H15ClFN3O2S MW 427.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClFN3O2S/c22-16-4-1-3-15(11-16)20-24-25-21(26(20)12-18-5-2-10-28-18)29-13-19(27)14-6-8-17(23)9-7-14/h1-11H,12-13H2
InChIKey
FFHDVHFUOJMHQH-UHFFFAOYSA-N
Synonyms
896837-74-4
2((5(3CHLOROPHENYL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)1(4FLUOROPHENYL)ETHANONE
2((5(3CHLOROPHENYL)4(FURAN2YLMETHYL)4H124TRIAZOL3YL)SULFANYL)1(4FLUOROPHENYL)ETHAN1ONE
2((5(3chlorophenyl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)1(4fluorophenyl)ethanone
2((5(3chlorophenyl)4(furan2ylmethyl)4H124triazol3yl)thio)1(4fluorophenyl)ethanone
2(5(3CHLOROPHENYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))1(4FLUOROPHENYL)ETHAN1ONE
896837744
C1=CC(=CC(=C1)Cl)C2=NN=C(N2CC3=CC=CO3)SCC(=O)C4=CC=C(C=C4)F
InChI=1SC21H15ClFN3O2Sc221641315(1116)20242521(26(20)121852102818)291319(27)146817(23)9714h111H1213H2
MFCD06600551
ZINC000002225491
ZINC02225491
ZINC2225491

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Available files

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