N-[4-(2-phenylphenyl)sulfanylbutyl]adamantan-2-amine

Systemtic Name: N-[4-(2-phenylphenyl)sulfanylbutyl]adamantan-2-amine Openeye Name: N-[4-(2-phenylphenyl)sulfanylbutyl]adamantan-2-amine CAS Name: N-[4-[(2-phenylphenyl)thio]butyl]-2-adamantanamine IUPAC Name: N-[4-(2-phenylphenyl)sulfanylbutyl]adamantan-2-amine Traditional Name: 2-adamantyl-[4-[(2-phenylphenyl)thio]butyl]amine Formula: C26H33NS MolecularWeight: 391.61192

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NCCCCSC4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NCCCCSC4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C26H33NS/c1-2-8-21(9-3-1)24-10-4-5-11-25(24)28-13-7-6-12-27-26-22-15-19-14-20(17-22)18-23(26)16-19/h1-5,8-11,19-20,22-23,26-27H,6-7,12-18H2