[2-[3,4-bis(fluoranyl)phenyl]sulfanyl-4-tert-butyl-cyclohexyl]methanamine

Systemtic Name: [2-[3,4-bis(fluoranyl)phenyl]sulfanyl-4-tert-butyl-cyclohexyl]methanamine Openeye Name: [4-tert-butyl-2-(3,4-difluorophenyl)sulfanyl-cyclohexyl]methanamine CAS Name: [4-tert-butyl-2-[(3,4-difluorophenyl)thio]cyclohexyl]methanamine IUPAC Name: [4-tert-butyl-2-(3,4-difluorophenyl)sulfanylcyclohexyl]methanamine Traditional Name: [4-tert-butyl-2-[(3,4-difluorophenyl)thio]cyclohexyl]methylamine Formula: C17H25F2NS MolecularWeight: 313.448906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(C(C1)SC2=CC(=C(C=C2)F)F)CN

Isomeric SMILES

CC(C)(C)C1CCC(C(C1)SC2=CC(=C(C=C2)F)F)CN

InChI

InChI=1S/C17H25F2NS/c1-17(2,3)12-5-4-11(10-20)16(8-12)21-13-6-7-14(18)15(19)9-13/h6-7,9,11-12,16H,4-5,8,10,20H2,1-3H3