1,1-bis(oxidanylidene)-2-(2-quinazolin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one

Systemtic Name: 1,1-bis(oxidanylidene)-2-(2-quinazolin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one Openeye Name: 1,1-dioxo-2-(2-quinazolin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one CAS Name: 1,1-dioxo-2-[2-(4-quinazolinylthio)ethyl]-1,2-benzothiazol-3-one IUPAC Name: 1,1-dioxo-2-(2-quinazolin-4-ylsulfanylethyl)-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[2-(quinazolin-4-ylthio)ethyl]-1,2-benzothiazol-3-one Formula: C17H13N3O3S2 MolecularWeight: 371.43342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)SCCN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C17H13N3O3S2/c21-17-13-6-2-4-8-15(13)25(22,23)20(17)9-10-24-16-12-5-1-3-7-14(12)18-11-19-16/h1-8,11H,9-10H2