5-cyclohexyl-1-[(1R)-1-phenylethyl]-1,3,5-triazinan-5-ium-2-thione

Systemtic Name: 5-cyclohexyl-1-[(1R)-1-phenylethyl]-1,3,5-triazinan-5-ium-2-thione Openeye Name: 5-cyclohexyl-1-[(1R)-1-phenylethyl]-1,3,5-triazinan-5-ium-2-thione CAS Name: 5-cyclohexyl-1-[(1R)-1-phenylethyl]-1,3,5-triazinan-5-ium-2-thione IUPAC Name: 5-cyclohexyl-1-[(1R)-1-phenylethyl]-1,3,5-triazinan-5-ium-2-thione Traditional Name: 5-cyclohexyl-1-[(1R)-1-phenylethyl]-1,3,5-triazinan-5-ium-2-thione Formula: C17H26N3S+ MolecularWeight: 304.47344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C[NH+](CNC2=S)C3CCCCC3

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C[NH+](CNC2=S)C3CCCCC3

InChI

InChI=1S/C17H25N3S/c1-14(15-8-4-2-5-9-15)20-13-19(12-18-17(20)21)16-10-6-3-7-11-16/h2,4-5,8-9,14,16H,3,6-7,10-13H2,1H3,(H,18,21)/p+1/t14-/m1/s1