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

Systemtic Name: 3-(3-chlorophenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione Openeye Name: 3-(3-chlorophenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione CAS Name: 3-(3-chlorophenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione IUPAC Name: 3-(3-chlorophenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione Traditional Name: 3-(3-chlorophenyl)-4,6,6-trimethyl-1,5-dihydropyrimidin-3-ium-2-thione Formula: C13H16ClN2S+ MolecularWeight: 267.79754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN2S/c1-9-8-13(2,3)15-12(17)16(9)11-6-4-5-10(14)7-11/h4-7H,8H2,1-3H3/p+1