Vitas-M small molecule compound

4-(furan-2-ylmethyl)-5-(propan-2-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK465323
SMILES Sc1nnc(n1Cc1ccco1)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 C10H13N3OS MW 223.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H13N3OS/c1-7(2)9-11-12-10(15)13(9)6-8-4-3-5-14-8/h3-5,7H,6H2,1-2H3,(H,12,15)
InChIKey
QBWGYOBIJCHIGP-UHFFFAOYSA-N
Synonyms
777875-15-7
4(2FURYLMETHYL)5(METHYLETHYL)124TRIAZOLE3THIOL
4(2FURYLMETHYL)5ISOPROPYL4H124TRIAZOLE3THIOL
4(furan2ylmethyl)3propan2yl1H124triazole5thione
4(furan2ylmethyl)5(propan2yl)4H124triazole3thiol
777875157
CC(C)C1=NNC(=S)N1CC2=CC=CO2
InChI=1SC10H13N3OSc17(2)9111210(15)13(9)68435148h357H6H212H3(H1215)
MFCD06758265
ZINC000012505075
ZINC12505075

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Available files

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