3-(4-oxidanylidenecinnolin-1-yl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide

Systemtic Name: 3-(4-oxidanylidenecinnolin-1-yl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide Openeye Name: N-(2-benzylsulfanylphenyl)-3-(4-oxocinnolin-1-yl)propanamide CAS Name: 3-(4-oxo-1-cinnolinyl)-N-[2-(phenylmethylthio)phenyl]propanamide IUPAC Name: N-(2-benzylsulfanylphenyl)-3-(4-oxocinnolin-1-yl)propanamide Traditional Name: N-[2-(benzylthio)phenyl]-3-(4-ketocinnolin-1-yl)propionamide Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CC=CC=C2NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CC=CC=C2NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C24H21N3O2S/c28-22-16-25-27(21-12-6-4-10-19(21)22)15-14-24(29)26-20-11-5-7-13-23(20)30-17-18-8-2-1-3-9-18/h1-13,16H,14-15,17H2,(H,26,29)