7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-methylsulfanylphenyl)methyl]quinolin-8-ol

Systemtic Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-methylsulfanylphenyl)methyl]quinolin-8-ol Openeye Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-methylsulfanylphenyl)methyl]quinolin-8-ol CAS Name: 7-[(R)-[(4-methyl-2-pyridin-1-iumyl)amino]-[4-(methylthio)phenyl]methyl]-8-quinolinol IUPAC Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-(4-methylsulfanylphenyl)methyl]quinolin-8-ol Traditional Name: 7-[(R)-[(4-methylpyridin-1-ium-2-yl)amino]-[4-(methylthio)phenyl]methyl]quinolin-8-ol Formula: C23H22N3OS+ MolecularWeight: 388.50528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=CC=C(C=C2)SC)C3=C(C4=C(C=CC=N4)C=C3)O

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@H](C2=CC=C(C=C2)SC)C3=C(C4=C(C=CC=N4)C=C3)O

InChI

InChI=1S/C23H21N3OS/c1-15-11-13-24-20(14-15)26-21(17-5-8-18(28-2)9-6-17)19-10-7-16-4-3-12-25-22(16)23(19)27/h3-14,21,27H,1-2H3,(H,24,26)/p+1/t21-/m1/s1