5-cyclohexyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-cyclohexyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-cyclohexyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-cyclohexyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-cyclohexyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-cyclohexyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione Formula: C21H26N3S+ MolecularWeight: 352.51624

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CN(C(=S)N(C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)[NH+]2CN(C(=S)N(C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3S/c25-21-23(19-12-6-2-7-13-19)16-22(18-10-4-1-5-11-18)17-24(21)20-14-8-3-9-15-20/h2-3,6-9,12-15,18H,1,4-5,10-11,16-17H2/p+1