3-[2-(1,3-benzothiazol-2-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(1,3-benzothiazol-2-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(1,3-benzothiazol-2-yl)ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(1,3-benzothiazol-2-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(1,3-benzothiazol-2-yl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(1,3-benzothiazol-2-yl)ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C17H13N3OS2 MolecularWeight: 339.43462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3OS2/c21-16-11-5-1-2-6-12(11)19-17(22)20(16)10-9-15-18-13-7-3-4-8-14(13)23-15/h1-8H,9-10H2,(H,19,22)