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

Systemtic Name: 5-[2-(cyclohexen-1-yl)ethyl]-1-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 1-benzyl-5-[2-(cyclohexen-1-yl)ethyl]-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-[2-(1-cyclohexenyl)ethyl]-1-(phenylmethyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 1-benzyl-5-[2-(cyclohexen-1-yl)ethyl]-1,3,5-triazinan-5-ium-2-thione Traditional Name: 1-benzyl-5-[2-(cyclohexen-1-yl)ethyl]-1,3,5-triazinan-5-ium-2-thione Formula: C18H26N3S+ MolecularWeight: 316.48414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CC[NH+]2CNC(=S)N(C2)CC3=CC=CC=C3

Isomeric SMILES

C1CCC(=CC1)CC[NH+]2CNC(=S)N(C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H25N3S/c22-18-19-14-20(12-11-16-7-3-1-4-8-16)15-21(18)13-17-9-5-2-6-10-17/h2,5-7,9-10H,1,3-4,8,11-15H2,(H,19,22)/p+1