2-[(7,11-dicyano-8-oxidanylidene-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-quinolin-8-yl-ethanamide

Systemtic Name: 2-[(7,11-dicyano-8-oxidanylidene-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-quinolin-8-yl-ethanamide Openeye Name: 2-[(7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(8-quinolyl)acetamide CAS Name: 2-[(7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)thio]-N-(8-quinolinyl)acetamide IUPAC Name: 2-[(7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-quinolin-8-ylacetamide Traditional Name: 2-[(7,11-dicyano-8-keto-9-azaspiro[5.5]undec-10-en-10-yl)thio]-N-(8-quinolyl)acetamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC4=C3N=CC=C4)C#N

Isomeric SMILES

C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC4=C3N=CC=C4)C#N

InChI

InChI=1S/C23H21N5O2S/c24-12-16-21(30)28-22(17(13-25)23(16)9-2-1-3-10-23)31-14-19(29)27-18-8-4-6-15-7-5-11-26-20(15)18/h4-8,11,16H,1-3,9-10,14H2,(H,27,29)(H,28,30)