[4-(2-methylbutan-2-yl)-2-phenylsulfanyl-cyclohexyl]methanamine

Systemtic Name: [4-(2-methylbutan-2-yl)-2-phenylsulfanyl-cyclohexyl]methanamine Openeye Name: [4-(1,1-dimethylpropyl)-2-phenylsulfanyl-cyclohexyl]methanamine CAS Name: [4-(2-methylbutan-2-yl)-2-(phenylthio)cyclohexyl]methanamine IUPAC Name: [4-(2-methylbutan-2-yl)-2-phenylsulfanylcyclohexyl]methanamine Traditional Name: [4-tert-amyl-2-(phenylthio)cyclohexyl]methylamine Formula: C18H29NS MolecularWeight: 291.49456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29NS/c1-4-18(2,3)15-11-10-14(13-19)17(12-15)20-16-8-6-5-7-9-16/h5-9,14-15,17H,4,10-13,19H2,1-3H3