2-[1,3-benzothiazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[1,3-benzothiazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[1,3-benzothiazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one CAS Name: 2-[1,3-benzothiazol-2-yl(mercapto)methyl]-1H-quinazolin-4-one IUPAC Name: 2-[1,3-benzothiazol-2-yl(sulfanyl)methyl]-1H-quinazolin-4-one Traditional Name: 2-[1,3-benzothiazol-2-yl(mercapto)methyl]-1H-quinazolin-4-one Formula: C16H11N3OS2 MolecularWeight: 325.40804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(C3=NC4=CC=CC=C4S3)S

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(C3=NC4=CC=CC=C4S3)S

InChI

InChI=1S/C16H11N3OS2/c20-15-9-5-1-2-6-10(9)17-14(19-15)13(21)16-18-11-7-3-4-8-12(11)22-16/h1-8,13,21H,(H,17,19,20)