2-[(3,5-dimethylphenyl)methylsulfanyl]-1-phenyl-cyclohexan-1-amine

Systemtic Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-1-phenyl-cyclohexan-1-amine Openeye Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-1-phenyl-cyclohexanamine CAS Name: 2-[(3,5-dimethylphenyl)methylthio]-1-phenyl-1-cyclohexanamine IUPAC Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-1-phenylcyclohexan-1-amine Traditional Name: [2-[(3,5-dimethylbenzyl)thio]-1-phenyl-cyclohexyl]amine Formula: C21H27NS MolecularWeight: 325.51078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2CCCCC2(C3=CC=CC=C3)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2CCCCC2(C3=CC=CC=C3)N)C

InChI

InChI=1S/C21H27NS/c1-16-12-17(2)14-18(13-16)15-23-20-10-6-7-11-21(20,22)19-8-4-3-5-9-19/h3-5,8-9,12-14,20H,6-7,10-11,15,22H2,1-2H3