Vitas-M small molecule compound

5-(3,4-dichlorobenzyl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK448298
SMILES Clc1ccc(cc1Cl)Cc1nnc(n1CC1CCCO1)S

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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 C14H15Cl2N3OS MW 344.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15Cl2N3OS/c15-11-4-3-9(6-12(11)16)7-13-17-18-14(21)19(13)8-10-2-1-5-20-10/h3-4,6,10H,1-2,5,7-8H2,(H,18,21)
InChIKey
IHVFIPSSXQRVRE-UHFFFAOYSA-N
Synonyms

3((34dichlorophenyl)methyl)4(oxolan2ylmethyl)1H124triazole5thione
5((34DICHLOROPHENYL)METHYL)4(OXOLAN2YLMETHYL)124TRIAZOLE3THIOL
5(34dichlorobenzyl)4(tetrahydrofuran2ylmethyl)4H124triazole3thiol
C1CC(OC1)CN2C(=NNC2=S)CC3=CC(=C(C=C3)Cl)Cl
InChI=1SC14H15Cl2N3OSc1511439(612(11)16)713171814(21)19(13)8102152010h34610H12578H2(H1821)
MFCD04140103
ZINC000006925722
ZINC000006925723

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Available files

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