[2-(4-tert-butylphenyl)sulfanylcycloheptyl]methanamine

Systemtic Name: [2-(4-tert-butylphenyl)sulfanylcycloheptyl]methanamine Openeye Name: [2-(4-tert-butylphenyl)sulfanylcycloheptyl]methanamine CAS Name: [2-[(4-tert-butylphenyl)thio]cycloheptyl]methanamine IUPAC Name: [2-(4-tert-butylphenyl)sulfanylcycloheptyl]methanamine Traditional Name: [2-[(4-tert-butylphenyl)thio]cycloheptyl]methylamine Formula: C18H29NS MolecularWeight: 291.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2CCCCCC2CN

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2CCCCCC2CN

InChI

InChI=1S/C18H29NS/c1-18(2,3)15-9-11-16(12-10-15)20-17-8-6-4-5-7-14(17)13-19/h9-12,14,17H,4-8,13,19H2,1-3H3