[4-[[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium

Systemtic Name: [4-[[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]methyl]phenyl]methyl-diethyl-azanium Openeye Name: [4-[[(2-chloro-5-methylsulfanyl-benzoyl)amino]methyl]phenyl]methyl-diethyl-ammonium CAS Name: [4-[[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]methyl]phenyl]methyl-diethylammonium IUPAC Name: [4-[[(2-chloro-5-methylsulfanylbenzoyl)amino]methyl]phenyl]methyl-diethylazanium Traditional Name: [4-[[[2-chloro-5-(methylthio)benzoyl]amino]methyl]benzyl]-diethyl-ammonium Formula: C20H26ClN2OS+ MolecularWeight: 377.95124

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)SC)Cl

Isomeric SMILES

CC[NH+](CC)CC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)SC)Cl

InChI

InChI=1S/C20H25ClN2OS/c1-4-23(5-2)14-16-8-6-15(7-9-16)13-22-20(24)18-12-17(25-3)10-11-19(18)21/h6-12H,4-5,13-14H2,1-3H3,(H,22,24)/p+1