Vitas-M small molecule compound

2-(2-fluorophenyl)-1,2,4-triazaspiro[4.5]decane-3-thione

Catalog ID
STK778196
SMILES S=C1NC2(NN1c1ccccc1F)CCCCC2

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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 C13H16FN3S MW 265.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16FN3S/c14-10-6-2-3-7-11(10)17-12(18)15-13(16-17)8-4-1-5-9-13/h2-3,6-7,16H,1,4-5,8-9H2,(H,15,18)
InChIKey
HPNWJAUZEOIJJE-UHFFFAOYSA-N
Synonyms
697234-05-2
124TRIAZASPIRO(45)DECANE3THIONE2(2FLUOROPHENYL)
2(2fluorophenyl)124triazaspiro(45)decane3thione
3(2FLUOROPHENYL)134TRIAZASPIRO(45)DECANE2THIONE
697234052
C1CCC2(CC1)NC(=S)N(N2)C3=CC=CC=C3F
InChI=1SC13H16FN3Sc1410623711(10)1712(18)1513(1617)8415913h236716H14589H2(H1518)
MFCD05855916
ZINC000001426986
ZINC01426986
ZINC1426986

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Available files

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