5-(2-adamantyl)-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-(2-adamantyl)-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-(2-adamantyl)-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-(2-adamantyl)-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-(2-adamantyl)-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-(2-adamantyl)-1,3,5-triazinan-5-ium-2-thione Formula: C13H22N3S+ MolecularWeight: 252.39888

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3[NH+]4CNC(=S)NC4

Isomeric SMILES

C1C2CC3CC1CC(C2)C3[NH+]4CNC(=S)NC4

InChI

InChI=1S/C13H21N3S/c17-13-14-6-16(7-15-13)12-10-2-8-1-9(4-10)5-11(12)3-8/h8-12H,1-7H2,(H2,14,15,17)/p+1