[4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]phenyl]methyl-cyclohexyl-dimethyl-azanium

Systemtic Name: [4-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]phenyl]methyl-cyclohexyl-dimethyl-azanium Openeye Name: [4-[(3-chlorobenzothiophene-2-carbonyl)amino]phenyl]methyl-cyclohexyl-dimethyl-ammonium CAS Name: [4-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]phenyl]methyl-cyclohexyl-dimethylammonium IUPAC Name: [4-[(3-chloro-1-benzothiophene-2-carbonyl)amino]phenyl]methyl-cyclohexyl-dimethylazanium Traditional Name: [4-[(3-chlorobenzothiophene-2-carbonyl)amino]benzyl]-cyclohexyl-dimethyl-ammonium Formula: C24H28ClN2OS+ MolecularWeight: 428.00992

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4CCCCC4

Isomeric SMILES

C[N+](C)(CC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4CCCCC4

InChI

InChI=1S/C24H27ClN2OS/c1-27(2,19-8-4-3-5-9-19)16-17-12-14-18(15-13-17)26-24(28)23-22(25)20-10-6-7-11-21(20)29-23/h6-7,10-15,19H,3-5,8-9,16H2,1-2H3/p+1