8-fluoranyl-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole

Systemtic Name: 8-fluoranyl-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole Openeye Name: 8-fluoro-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole CAS Name: 8-fluoro-3-(phenethylthio)-5-propyl-[1,2,4]triazino[5,6-b]indole IUPAC Name: 8-fluoro-3-phenethylsulfanyl-5-propyl-[1,2,4]triazino[5,6-b]indole Traditional Name: 8-fluoro-3-(phenethylthio)-5-propyl-[1,2,4]triazin[5,6-b]indole Formula: C20H19FN4S MolecularWeight: 366.455063

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)F)C3=C1N=C(N=N3)SCCC4=CC=CC=C4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)F)C3=C1N=C(N=N3)SCCC4=CC=CC=C4

InChI

InChI=1S/C20H19FN4S/c1-2-11-25-17-9-8-15(21)13-16(17)18-19(25)22-20(24-23-18)26-12-10-14-6-4-3-5-7-14/h3-9,13H,2,10-12H2,1H3