3-[2-(phenylmethylsulfanyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(phenylmethylsulfanyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(2-benzylsulfanylethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(phenylmethylthio)ethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(2-benzylsulfanylethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(benzylthio)ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

C1=CC=C(C=C1)CSCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C17H16N2OS2/c20-16-14-8-4-5-9-15(14)18-17(21)19(16)10-11-22-12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H,18,21)