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

Systemtic Name: 3-phenyl-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-phenyl-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-phenyl-2-[(1-propyl-5-tetrazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-phenyl-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-phenyl-2-[(1-propyltetrazol-5-yl)methylthio]quinazolin-4-one Formula: C19H18N6OS MolecularWeight: 378.45082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C19H18N6OS/c1-2-12-24-17(21-22-23-24)13-27-19-20-16-11-7-6-10-15(16)18(26)25(19)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3