2-hexyl-1-(5-methylsulfanylpentyl)imidazo[4,5-c]quinoline

Systemtic Name: 2-hexyl-1-(5-methylsulfanylpentyl)imidazo[4,5-c]quinoline Openeye Name: 2-hexyl-1-(5-methylsulfanylpentyl)imidazo[4,5-c]quinoline CAS Name: 2-hexyl-1-[5-(methylthio)pentyl]imidazo[4,5-c]quinoline IUPAC Name: 2-hexyl-1-(5-methylsulfanylpentyl)imidazo[4,5-c]quinoline Traditional Name: 2-hexyl-1-[5-(methylthio)pentyl]imidazo[4,5-c]quinoline Formula: C22H31N3S MolecularWeight: 369.56664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NC2=C(N1CCCCCSC)C3=CC=CC=C3N=C2

Isomeric SMILES

CCCCCCC1=NC2=C(N1CCCCCSC)C3=CC=CC=C3N=C2

InChI

InChI=1S/C22H31N3S/c1-3-4-5-7-14-21-24-20-17-23-19-13-9-8-12-18(19)22(20)25(21)15-10-6-11-16-26-2/h8-9,12-13,17H,3-7,10-11,14-16H2,1-2H3