3-phenyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-phenyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-phenyl-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-phenyl-2-[[(1-phenyl-5-tetrazolyl)thio]methyl]-4-quinazolinone IUPAC Name: 3-phenyl-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-phenyl-2-[[(1-phenyltetrazol-5-yl)thio]methyl]quinazolin-4-one Formula: C22H16N6OS MolecularWeight: 412.46704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C22H16N6OS/c29-21-18-13-7-8-14-19(18)23-20(27(21)16-9-3-1-4-10-16)15-30-22-24-25-26-28(22)17-11-5-2-6-12-17/h1-14H,15H2