3-(3-hydroxyphenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione

Systemtic Name: 3-(3-hydroxyphenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione Openeye Name: 3-(3-hydroxyphenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione CAS Name: 3-(3-hydroxyphenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione IUPAC Name: 3-(3-hydroxyphenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione Traditional Name: 3-(3-hydroxyphenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione Formula: C13H17N2OS+ MolecularWeight: 249.35188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2OS/c1-9-8-13(2,3)14-12(17)15(9)10-5-4-6-11(16)7-10/h4-7H,8H2,1-3H3,(H-,14,16,17)/p+1