5-[2-(cyclohexen-1-yl)ethyl]-1-(2,5-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-[2-(cyclohexen-1-yl)ethyl]-1-(2,5-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-[2-(cyclohexen-1-yl)ethyl]-1-(2,5-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-[2-(1-cyclohexenyl)ethyl]-1-(2,5-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-[2-(cyclohexen-1-yl)ethyl]-1-(2,5-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-[2-(cyclohexen-1-yl)ethyl]-1-(2,5-dimethylphenyl)-1,3,5-triazinan-5-ium-2-thione Formula: C19H28N3S+ MolecularWeight: 330.51072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C[NH+](CNC2=S)CCC3=CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C[NH+](CNC2=S)CCC3=CCCCC3

InChI

InChI=1S/C19H27N3S/c1-15-8-9-16(2)18(12-15)22-14-21(13-20-19(22)23)11-10-17-6-4-3-5-7-17/h6,8-9,12H,3-5,7,10-11,13-14H2,1-2H3,(H,20,23)/p+1