Vitas-M small molecule compound

5-(4-tert-butylphenyl)-3-{[(4-chlorophenyl)amino]methyl}-1,3,4-oxadiazole-2(3H)-thione

Catalog ID
STK794900
SMILES Clc1ccc(cc1)NCn1nc(oc1=S)c1ccc(cc1)C(C)(C)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 C19H20ClN3OS MW 373.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClN3OS/c1-19(2,3)14-6-4-13(5-7-14)17-22-23(18(25)24-17)12-21-16-10-8-15(20)9-11-16/h4-11,21H,12H2,1-3H3
InChIKey
WUIDQUFENDSYJL-UHFFFAOYSA-N
Synonyms

5(4tertbutylphenyl)3(((4chlorophenyl)amino)methyl)134oxadiazole2(3H)thione
5(4TERTBUTYLPHENYL)3((4CHLOROANILINO)METHYL)134OXADIAZOLE2THIONE
CC(C)(C)C1=CC=C(C=C1)C2=NN(C(=S)O2)CNC3=CC=C(C=C3)Cl
InChI=1SC19H20ClN3OSc119(23)146413(5714)172223(18(25)2417)12211610815(20)91116h41121H12H213H3
MFCD01125030
ZINC000002810527
ZINC02810527
ZINC2810527

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Available files

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