Vitas-M small molecule compound

N-(4-fluoro-2-methylphenyl)-2-{[5-(furan-2-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK498133
SMILES CC(Cn1c(SCC(=O)Nc2ccc(cc2C)F)nnc1c1ccco1)C

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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 C19H21FN4O2S MW 388.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21FN4O2S/c1-12(2)10-24-18(16-5-4-8-26-16)22-23-19(24)27-11-17(25)21-15-7-6-14(20)9-13(15)3/h4-9,12H,10-11H2,1-3H3,(H,21,25)
InChIKey
LSQZXQLZNAOSBM-UHFFFAOYSA-N
Synonyms

CC1=C(C=CC(=C1)F)NC(=O)CSC2=NN=C(N2CC(C)C)C3=CC=CO3
InChI=1SC19H21FN4O2Sc112(2)102418(165482616)222319(24)271117(25)21157614(20)913(15)3h4912H1011H213H3(H2125)
MFCD11855302
N(4fluoro2methylphenyl)2((5(furan2yl)4(2methylpropyl)124triazol3yl)sulfanyl)acetamide
N(4fluoro2methylphenyl)2((5(furan2yl)4(2methylpropyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000032579568
ZINC32579568

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Available files

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