2-(2,1,3-benzothiadiazol-4-ylmethylsulfanyl)-3-phenethyl-quinazolin-4-one

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-ylmethylsulfanyl)-3-phenethyl-quinazolin-4-one Openeye Name: 2-(2,1,3-benzothiadiazol-4-ylmethylsulfanyl)-3-phenethyl-quinazolin-4-one CAS Name: 2-(2,1,3-benzothiadiazol-4-ylmethylthio)-3-phenethyl-4-quinazolinone IUPAC Name: 2-(2,1,3-benzothiadiazol-4-ylmethylsulfanyl)-3-phenethylquinazolin-4-one Traditional Name: 3-phenethyl-2-(piazthiol-4-ylmethylthio)quinazolin-4-one Formula: C23H18N4OS2 MolecularWeight: 430.54522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC5=NSN=C54

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC5=NSN=C54

InChI

InChI=1S/C23H18N4OS2/c28-22-18-10-4-5-11-19(18)24-23(27(22)14-13-16-7-2-1-3-8-16)29-15-17-9-6-12-20-21(17)26-30-25-20/h1-12H,13-15H2