5-cyclohexyl-1-(3-methoxyphenyl)-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-cyclohexyl-1-(3-methoxyphenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-cyclohexyl-1-(3-methoxyphenyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-cyclohexyl-1-(3-methoxyphenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-cyclohexyl-1-(3-methoxyphenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-cyclohexyl-1-(3-methoxyphenyl)-1,3,5-triazinan-5-ium-2-thione Formula: C16H24N3OS+ MolecularWeight: 306.44626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C[NH+](CNC2=S)C3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)N2C[NH+](CNC2=S)C3CCCCC3

InChI

InChI=1S/C16H23N3OS/c1-20-15-9-5-8-14(10-15)19-12-18(11-17-16(19)21)13-6-3-2-4-7-13/h5,8-10,13H,2-4,6-7,11-12H2,1H3,(H,17,21)/p+1