3-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-1,2,3-benzotriazin-4-one

Systemtic Name: 3-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-1,2,3-benzotriazin-4-one Openeye Name: 3-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-1,2,3-benzotriazin-4-one CAS Name: 3-[(6-benzimidazolo[1,2-c]quinazolinylthio)methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanylmethyl)-1,2,3-benzotriazin-4-one Traditional Name: 3-[(benzimidazolo[1,2-c]quinazolin-6-ylthio)methyl]-1,2,3-benzotriazin-4-one Formula: C22H14N6OS MolecularWeight: 410.45116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N3C(=N2)SCN5C(=O)C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C2C(=C1)C3=NC4=CC=CC=C4N3C(=N2)SCN5C(=O)C6=CC=CC=C6N=N5

InChI

InChI=1S/C22H14N6OS/c29-21-15-8-2-4-10-17(15)25-26-27(21)13-30-22-24-16-9-3-1-7-14(16)20-23-18-11-5-6-12-19(18)28(20)22/h1-12H,13H2