4-(aminomethyl)-4-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]cyclohexan-1-amine

Systemtic Name: 4-(aminomethyl)-4-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]cyclohexan-1-amine Openeye Name: 4-(aminomethyl)-4-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]cyclohexanamine CAS Name: 4-(aminomethyl)-4-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]-1-cyclohexanamine IUPAC Name: 4-(aminomethyl)-4-(3-chlorophenyl)-N-[(4-methylsulfonylphenyl)methyl]cyclohexan-1-amine Traditional Name: [4-(aminomethyl)-4-(3-chlorophenyl)cyclohexyl]-(4-mesylbenzyl)amine Formula: C21H27ClN2O2S MolecularWeight: 406.96928

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC2CCC(CC2)(CN)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC2CCC(CC2)(CN)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H27ClN2O2S/c1-27(25,26)20-7-5-16(6-8-20)14-24-19-9-11-21(15-23,12-10-19)17-3-2-4-18(22)13-17/h2-8,13,19,24H,9-12,14-15,23H2,1H3