2-[(4-chlorophenyl)methyl]quinazoline-4-thiolate

Systemtic Name: 2-[(4-chlorophenyl)methyl]quinazoline-4-thiolate Openeye Name: 2-[(4-chlorophenyl)methyl]quinazoline-4-thiolate CAS Name: 2-[(4-chlorophenyl)methyl]-4-quinazolinethiolate IUPAC Name: 2-[(4-chlorophenyl)methyl]quinazoline-4-thiolate Traditional Name: 2-(4-chlorobenzyl)quinazoline-4-thiolate Formula: C15H10ClN2S- MolecularWeight: 285.7713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)CC3=CC=C(C=C3)Cl)[S-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)CC3=CC=C(C=C3)Cl)[S-]

InChI

InChI=1S/C15H11ClN2S/c16-11-7-5-10(6-8-11)9-14-17-13-4-2-1-3-12(13)15(19)18-14/h1-8H,9H2,(H,17,18,19)/p-1