[2-(3,4-dimethylphenyl)sulfanylcycloheptyl]methanamine

Systemtic Name: [2-(3,4-dimethylphenyl)sulfanylcycloheptyl]methanamine Openeye Name: [2-(3,4-dimethylphenyl)sulfanylcycloheptyl]methanamine CAS Name: [2-[(3,4-dimethylphenyl)thio]cycloheptyl]methanamine IUPAC Name: [2-(3,4-dimethylphenyl)sulfanylcycloheptyl]methanamine Traditional Name: [2-[(3,4-dimethylphenyl)thio]cycloheptyl]methylamine Formula: C16H25NS MolecularWeight: 263.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2CCCCCC2CN)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2CCCCCC2CN)C

InChI

InChI=1S/C16H25NS/c1-12-8-9-15(10-13(12)2)18-16-7-5-3-4-6-14(16)11-17/h8-10,14,16H,3-7,11,17H2,1-2H3