4,6,6-trimethyl-3-phenethyl-1,5-dihydropyrimidin-3-ium-2-thione

Systemtic Name: 4,6,6-trimethyl-3-phenethyl-1,5-dihydropyrimidin-3-ium-2-thione Openeye Name: 4,6,6-trimethyl-3-phenethyl-1,5-dihydropyrimidin-3-ium-2-thione CAS Name: 4,6,6-trimethyl-3-phenethyl-1,5-dihydropyrimidin-3-ium-2-thione IUPAC Name: 4,6,6-trimethyl-3-phenethyl-1,5-dihydropyrimidin-3-ium-2-thione Traditional Name: 4,6,6-trimethyl-3-phenethyl-1,5-dihydropyrimidin-3-ium-2-thione Formula: C15H21N2S+ MolecularWeight: 261.40564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=S)NC(C1)(C)C)CCC2=CC=CC=C2

Isomeric SMILES

CC1=[N+](C(=S)NC(C1)(C)C)CCC2=CC=CC=C2

InChI

InChI=1S/C15H20N2S/c1-12-11-15(2,3)16-14(18)17(12)10-9-13-7-5-4-6-8-13/h4-8H,9-11H2,1-3H3/p+1