2,6-bis(azanyl)-8-[1H-imidazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2,6-bis(azanyl)-8-[1H-imidazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one Openeye Name: 2,6-diamino-8-[1H-imidazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one CAS Name: 2,6-diamino-8-[1H-imidazol-2-yl(mercapto)methyl]-1H-quinazolin-4-one IUPAC Name: 2,6-diamino-8-[1H-imidazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one Traditional Name: 2,6-diamino-8-[1H-imidazol-2-yl(mercapto)methyl]-1H-quinazolin-4-one Formula: C12H12N6OS MolecularWeight: 288.32828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N1)C(C2=C3C(=CC(=C2)N)C(=O)N=C(N3)N)S

Isomeric SMILES

C1=CN=C(N1)C(C2=C3C(=CC(=C2)N)C(=O)N=C(N3)N)S

InChI

InChI=1S/C12H12N6OS/c13-5-3-6(9(20)10-15-1-2-16-10)8-7(4-5)11(19)18-12(14)17-8/h1-4,9,20H,13H2,(H,15,16)(H3,14,17,18,19)