2-(4-chlorophenyl)-1-methyl-4aH-quinazolin-1-ium-4-thione

Systemtic Name: 2-(4-chlorophenyl)-1-methyl-4aH-quinazolin-1-ium-4-thione Openeye Name: 2-(4-chlorophenyl)-1-methyl-4aH-quinazolin-1-ium-4-thione CAS Name: 2-(4-chlorophenyl)-1-methyl-4aH-quinazolin-1-ium-4-thione IUPAC Name: 2-(4-chlorophenyl)-1-methyl-4aH-quinazolin-1-ium-4-thione Traditional Name: 2-(4-chlorophenyl)-1-methyl-4aH-quinazolin-1-ium-4-thione Formula: C15H12ClN2S+ MolecularWeight: 287.78718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC=CC2C(=S)N=C1C3=CC=C(C=C3)Cl

Isomeric SMILES

C[N+]1=C2C=CC=CC2C(=S)N=C1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClN2S/c1-18-13-5-3-2-4-12(13)15(19)17-14(18)10-6-8-11(16)9-7-10/h2-9,12H,1H3/q+1