3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione

Systemtic Name: 3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Openeye Name: 3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione CAS Name: 3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione IUPAC Name: 3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Traditional Name: 3-(4-bromophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Formula: C13H15BrN2S MolecularWeight: 311.2406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC(=S)N1C2=CC=C(C=C2)Br)(C)C

Isomeric SMILES

CC1=CC(NC(=S)N1C2=CC=C(C=C2)Br)(C)C

InChI

InChI=1S/C13H15BrN2S/c1-9-8-13(2,3)15-12(17)16(9)11-6-4-10(14)5-7-11/h4-8H,1-3H3,(H,15,17)