[2-[2,5-bis(chloranyl)phenyl]sulfanylcycloheptyl]methanamine

Systemtic Name: [2-[2,5-bis(chloranyl)phenyl]sulfanylcycloheptyl]methanamine Openeye Name: [2-(2,5-dichlorophenyl)sulfanylcycloheptyl]methanamine CAS Name: [2-[(2,5-dichlorophenyl)thio]cycloheptyl]methanamine IUPAC Name: [2-(2,5-dichlorophenyl)sulfanylcycloheptyl]methanamine Traditional Name: [2-[(2,5-dichlorophenyl)thio]cycloheptyl]methylamine Formula: C14H19Cl2NS MolecularWeight: 304.27836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(CC1)SC2=C(C=CC(=C2)Cl)Cl)CN

Isomeric SMILES

C1CCC(C(CC1)SC2=C(C=CC(=C2)Cl)Cl)CN

InChI

InChI=1S/C14H19Cl2NS/c15-11-6-7-12(16)14(8-11)18-13-5-3-1-2-4-10(13)9-17/h6-8,10,13H,1-5,9,17H2