Vitas-M small molecule compound

3-[(4-fluorobenzyl)sulfanyl]-5-propyl-5H-[1,2,4]triazino[5,6-b]indole

Catalog ID
STK285489
SMILES CCCn1c2ccccc2c2c1nc(SCc1ccc(cc1)F)nn2

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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 C19H17FN4S MW 352.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17FN4S/c1-2-11-24-16-6-4-3-5-15(16)17-18(24)21-19(23-22-17)25-12-13-7-9-14(20)10-8-13/h3-10H,2,11-12H2,1H3
InChIKey
AILAKCQVESFQBJ-UHFFFAOYSA-N
Synonyms
931374-76-4
3((4fluorobenzyl)sulfanyl)5propyl5H(124)triazino(56b)indole
3((4fluorophenyl)methylsulfanyl)5propyl(124)triazino(56b)indole
931374764
CCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC4=CC=C(C=C4)F
InChI=1SC19H17FN4Sc12112416643515(16)1718(24)2119(232217)2512137914(20)10813h310H21112H21H3
MFCD09270959
ZINC000009261922
ZINC09261922
ZINC9261922

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Available files

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