2-(3H-imidazo[4,5-e][2,1,3]benzothiadiazol-7-ylsulfanylmethyl)-3-phenyl-quinazolin-4-one

Systemtic Name: 2-(3H-imidazo[4,5-e][2,1,3]benzothiadiazol-7-ylsulfanylmethyl)-3-phenyl-quinazolin-4-one Openeye Name: 2-(3H-imidazo[4,5-e][2,1,3]benzothiadiazol-7-ylsulfanylmethyl)-3-phenyl-quinazolin-4-one CAS Name: 2-[(3H-imidazo[4,5-e][2,1,3]benzothiadiazol-7-ylthio)methyl]-3-phenyl-4-quinazolinone IUPAC Name: 2-(3H-imidazo[4,5-e][2,1,3]benzothiadiazol-7-ylsulfanylmethyl)-3-phenylquinazolin-4-one Traditional Name: 2-[(3H-imidazo[4,5-e][2,1,3]benzothiadiazol-7-ylthio)methyl]-3-phenyl-quinazolin-4-one Formula: C22H14N6OS2 MolecularWeight: 442.51616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NC5=CC=C6C(=NSN6)C5=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NC5=CC=C6C(=NSN6)C5=N4

InChI

InChI=1S/C22H14N6OS2/c29-21-14-8-4-5-9-15(14)23-18(28(21)13-6-2-1-3-7-13)12-30-22-24-16-10-11-17-20(19(16)25-22)27-31-26-17/h1-11,26H,12H2