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

Systemtic Name: 5-cyclohexyl-1-(2,3-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-cyclohexyl-1-(2,3-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-cyclohexyl-1-(2,3-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-cyclohexyl-1-(2,3-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-cyclohexyl-1-(2,3-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione Formula: C17H26N3S+ MolecularWeight: 304.47344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C[NH+](CNC2=S)C3CCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C[NH+](CNC2=S)C3CCCCC3)C

InChI

InChI=1S/C17H25N3S/c1-13-7-6-10-16(14(13)2)20-12-19(11-18-17(20)21)15-8-4-3-5-9-15/h6-7,10,15H,3-5,8-9,11-12H2,1-2H3,(H,18,21)/p+1