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

Systemtic Name: 1-methyl-2-(4-methylphenyl)-4aH-quinazolin-1-ium-4-thione Openeye Name: 1-methyl-2-(p-tolyl)-4aH-quinazolin-1-ium-4-thione CAS Name: 1-methyl-2-(4-methylphenyl)-4aH-quinazolin-1-ium-4-thione IUPAC Name: 1-methyl-2-(4-methylphenyl)-4aH-quinazolin-1-ium-4-thione Traditional Name: 1-methyl-2-(p-tolyl)-4aH-quinazolin-1-ium-4-thione Formula: C16H15N2S+ MolecularWeight: 267.3687

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=S)C3C=CC=CC3=[N+]2C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=S)C3C=CC=CC3=[N+]2C

InChI

InChI=1S/C16H15N2S/c1-11-7-9-12(10-8-11)15-17-16(19)13-5-3-4-6-14(13)18(15)2/h3-10,13H,1-2H3/q+1