Vitas-M small molecule compound

butyl [5-(2-fluorobenzyl)-1,3,4-thiadiazol-2-yl]carbamate

Catalog ID
STK386017
SMILES CCCCOC(=O)Nc1nnc(s1)Cc1ccccc1F

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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 C14H16FN3O2S MW 309.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16FN3O2S/c1-2-3-8-20-14(19)16-13-18-17-12(21-13)9-10-6-4-5-7-11(10)15/h4-7H,2-3,8-9H2,1H3,(H,16,18,19)
InChIKey
CWJHYFNIOCNYGI-UHFFFAOYSA-N
Synonyms

(5(2FLUOROBENZYL)(134)THIADIAZOL2YL)CARBAMICACIDBUTYLESTER
BUTOXYN(5((2FLUOROPHENYL)METHYL)(134THIADIAZOL2YL))CARBOXAMIDE
BUTYL(5(2FLUOROBENZYL)134THIADIAZOL2YL)CARBAMATE
BUTYLN(5((2FLUOROPHENYL)METHYL)134THIADIAZOL2YL)CARBAMATE
CCCCOC(=O)NC1=NN=C(S1)CC2=CC=CC=C2F
InChI=1SC14H16FN3O2Sc12382014(19)1613181712(2113)910645711(10)15h47H2389H21H3(H161819)
MFCD01364187
ZINC000004178881
ZINC04178881
ZINC4178881

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Available files

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