2-(4-ethylpiperazin-1-yl)-4-methyl-6-methylsulfanyl-quinolin-1-ium

Systemtic Name: 2-(4-ethylpiperazin-1-yl)-4-methyl-6-methylsulfanyl-quinolin-1-ium Openeye Name: 2-(4-ethylpiperazin-1-yl)-4-methyl-6-methylsulfanyl-quinolin-1-ium CAS Name: 2-(4-ethyl-1-piperazinyl)-4-methyl-6-(methylthio)quinolin-1-ium IUPAC Name: 2-(4-ethylpiperazin-1-yl)-4-methyl-6-methylsulfanylquinolin-1-ium Traditional Name: 2-(4-ethylpiperazino)-4-methyl-6-(methylthio)quinolin-1-ium Formula: C17H24N3S+ MolecularWeight: 302.45756

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=[NH+]C3=C(C=C(C=C3)SC)C(=C2)C

Isomeric SMILES

CCN1CCN(CC1)C2=[NH+]C3=C(C=C(C=C3)SC)C(=C2)C

InChI

InChI=1S/C17H23N3S/c1-4-19-7-9-20(10-8-19)17-11-13(2)15-12-14(21-3)5-6-16(15)18-17/h5-6,11-12H,4,7-10H2,1-3H3/p+1