2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(3-cyano-5-oxidanylidene-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-morpholinosulfonylphenyl)acetamide CAS Name: 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)thio]-N-[3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3-cyano-5-oxo-7,8-dihydro-6H-quinolin-2-yl)sulfanyl]-N-(3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-cyano-5-keto-7,8-dihydro-6H-quinolin-2-yl)thio]-N-(3-morpholinosulfonylphenyl)acetamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C(=N2)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C#N)C(=O)C1

Isomeric SMILES

C1CC2=C(C=C(C(=N2)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C#N)C(=O)C1

InChI

InChI=1S/C22H22N4O5S2/c23-13-15-11-18-19(5-2-6-20(18)27)25-22(15)32-14-21(28)24-16-3-1-4-17(12-16)33(29,30)26-7-9-31-10-8-26/h1,3-4,11-12H,2,5-10,14H2,(H,24,28)