2-adamantyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: 2-adamantyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: 2-adamantyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: 2-adamantyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: 2-adamantyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: 2-adamantyl-[4-(methylthio)benzyl]ammonium Formula: C18H26NS+ MolecularWeight: 288.47074

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C[NH2+]C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CSC1=CC=C(C=C1)C[NH2+]C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C18H25NS/c1-20-17-4-2-12(3-5-17)11-19-18-15-7-13-6-14(9-15)10-16(18)8-13/h2-5,13-16,18-19H,6-11H2,1H3/p+1