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

Systemtic Name: 5-cycloheptyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-cycloheptyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-cycloheptyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-cycloheptyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-cycloheptyl-1,3-diphenyl-1,3,5-triazinan-5-ium-2-thione Formula: C22H28N3S+ MolecularWeight: 366.54282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CN(C(=S)N(C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)[NH+]2CN(C(=S)N(C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N3S/c26-22-24(20-13-7-3-8-14-20)17-23(19-11-5-1-2-6-12-19)18-25(22)21-15-9-4-10-16-21/h3-4,7-10,13-16,19H,1-2,5-6,11-12,17-18H2/p+1