2-[(7,11-dicyano-8-oxidanylidene-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(2,4-dimethylphenyl)ethanamide

Systemtic Name: 2-[(7,11-dicyano-8-oxidanylidene-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(2,4-dimethylphenyl)ethanamide Openeye Name: 2-[(7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide CAS Name: 2-[(7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)thio]-N-(2,4-dimethylphenyl)acetamide IUPAC Name: 2-[(7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(2,4-dimethylphenyl)acetamide Traditional Name: 2-[(7,11-dicyano-8-keto-9-azaspiro[5.5]undec-10-en-10-yl)thio]-N-(2,4-dimethylphenyl)acetamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=C(C3(CCCCC3)C(C(=O)N2)C#N)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=C(C3(CCCCC3)C(C(=O)N2)C#N)C#N)C

InChI

InChI=1S/C22H24N4O2S/c1-14-6-7-18(15(2)10-14)25-19(27)13-29-21-17(12-24)22(8-4-3-5-9-22)16(11-23)20(28)26-21/h6-7,10,16H,3-5,8-9,13H2,1-2H3,(H,25,27)(H,26,28)