Vitas-M small molecule compound

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

Catalog ID
STK230695
SMILES Fc1ccc(cc1)C(=O)CSc1nnc(n1C(C)C)c1ccco1

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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 C17H16FN3O2S MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN3O2S/c1-11(2)21-16(15-4-3-9-23-15)19-20-17(21)24-10-14(22)12-5-7-13(18)8-6-12/h3-9,11H,10H2,1-2H3
InChIKey
RIQANKBBMCIDPJ-UHFFFAOYSA-N
Synonyms

1(4fluorophenyl)2((5(furan2yl)4(propan2yl)4H124triazol3yl)sulfanyl)ethanone
1(4FLUOROPHENYL)2((5(FURAN2YL)4PROPAN2YL124TRIAZOL3YL)SULFANYL)ETHANONE
CC(C)N1C(=NN=C1SCC(=O)C2=CC=C(C=C2)F)C3=CC=CO3
InChI=1SC17H16FN3O2Sc111(2)2116(154392315)192017(21)241014(22)125713(18)8612h3911H10H212H3
MFCD07791486
ZINC000004736094
ZINC04736094
ZINC4736094

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Available files

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