N-[4-(4-bromophenyl)sulfanylphenyl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide

Systemtic Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide Openeye Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-(4-oxocinnolin-1-yl)propanamide CAS Name: N-[4-[(4-bromophenyl)thio]phenyl]-3-(4-oxo-1-cinnolinyl)propanamide IUPAC Name: N-[4-(4-bromophenyl)sulfanylphenyl]-3-(4-oxocinnolin-1-yl)propanamide Traditional Name: N-[4-[(4-bromophenyl)thio]phenyl]-3-(4-ketocinnolin-1-yl)propionamide Formula: C23H18BrN3O2S MolecularWeight: 480.37692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=NN2CCC(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=NN2CCC(=O)NC3=CC=C(C=C3)SC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H18BrN3O2S/c24-16-5-9-18(10-6-16)30-19-11-7-17(8-12-19)26-23(29)13-14-27-21-4-2-1-3-20(21)22(28)15-25-27/h1-12,15H,13-14H2,(H,26,29)