methyl-[(4-methylsulfanylphenyl)methyl]-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Openeye Name: methyl-[(1R)-1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Traditional Name: [(1R)-2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C20H24N3O2S+ MolecularWeight: 370.48846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC(=O)NC2=CC=CC=C21)[NH+](C)CC3=CC=C(C=C3)SC

Isomeric SMILES

C[C@H](C(=O)N1CC(=O)NC2=CC=CC=C21)[NH+](C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H23N3O2S/c1-14(22(2)12-15-8-10-16(26-3)11-9-15)20(25)23-13-19(24)21-17-6-4-5-7-18(17)23/h4-11,14H,12-13H2,1-3H3,(H,21,24)/p+1/t14-/m1/s1