4-methyl-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-8-methylsulfanyl-quinoline

Systemtic Name: 4-methyl-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-8-methylsulfanyl-quinoline Openeye Name: 4-methyl-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-8-methylsulfanyl-quinoline CAS Name: 4-methyl-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-8-(methylthio)quinoline IUPAC Name: 4-methyl-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-8-methylsulfanylquinoline Traditional Name: 4-methyl-2-(4-methyl-1,4-diazepan-4-ium-1-yl)-8-(methylthio)quinoline Formula: C17H24N3S+ MolecularWeight: 302.45756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2SC)N3CCC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2SC)N3CCC[NH+](CC3)C

InChI

InChI=1S/C17H23N3S/c1-13-12-16(20-9-5-8-19(2)10-11-20)18-17-14(13)6-4-7-15(17)21-3/h4,6-7,12H,5,8-11H2,1-3H3/p+1