[4-[(3,4-dichlorophenyl)carbonylamino]phenyl]methyl-dimethyl-(thian-4-yl)azanium

Systemtic Name: [4-[(3,4-dichlorophenyl)carbonylamino]phenyl]methyl-dimethyl-(thian-4-yl)azanium Openeye Name: [4-[(3,4-dichlorobenzoyl)amino]phenyl]methyl-dimethyl-tetrahydrothiopyran-4-yl-ammonium CAS Name: [4-[[(3,4-dichlorophenyl)-oxomethyl]amino]phenyl]methyl-dimethyl-(4-thianyl)ammonium IUPAC Name: [4-[(3,4-dichlorobenzoyl)amino]phenyl]methyl-dimethyl-(thian-4-yl)azanium Traditional Name: [4-[(3,4-dichlorobenzoyl)amino]benzyl]-dimethyl-tetrahydrothiopyran-4-yl-ammonium Formula: C21H25Cl2N2OS+ MolecularWeight: 424.407

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)Cl)C3CCSCC3

Isomeric SMILES

C[N+](C)(CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)Cl)C3CCSCC3

InChI

InChI=1S/C21H24Cl2N2OS/c1-25(2,18-9-11-27-12-10-18)14-15-3-6-17(7-4-15)24-21(26)16-5-8-19(22)20(23)13-16/h3-8,13,18H,9-12,14H2,1-2H3/p+1