3-(benzotriazol-1-ylmethylamino)-2-methyl-quinazolin-4-one

Systemtic Name: 3-(benzotriazol-1-ylmethylamino)-2-methyl-quinazolin-4-one Openeye Name: 3-(benzotriazol-1-ylmethylamino)-2-methyl-quinazolin-4-one CAS Name: 3-(1-benzotriazolylmethylamino)-2-methyl-4-quinazolinone IUPAC Name: 3-(benzotriazol-1-ylmethylamino)-2-methylquinazolin-4-one Traditional Name: 3-(benzotriazol-1-ylmethylamino)-2-methyl-quinazolin-4-one Formula: C16H14N6O MolecularWeight: 306.32196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1NCN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1NCN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H14N6O/c1-11-18-13-7-3-2-6-12(13)16(23)22(11)17-10-21-15-9-5-4-8-14(15)19-20-21/h2-9,17H,10H2,1H3