2-[(3-tert-butyl-7,11-dicyano-8-oxidanylidene-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[(3-tert-butyl-7,11-dicyano-8-oxidanylidene-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[(3-tert-butyl-7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(m-tolyl)acetamide CAS Name: 2-[(3-tert-butyl-7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[(3-tert-butyl-7,11-dicyano-8-oxo-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[(3-tert-butyl-7,11-dicyano-8-keto-9-azaspiro[5.5]undec-10-en-10-yl)thio]-N-(m-tolyl)acetamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=C(C3(CCC(CC3)C(C)(C)C)C(C(=O)N2)C#N)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=C(C3(CCC(CC3)C(C)(C)C)C(C(=O)N2)C#N)C#N

InChI

InChI=1S/C25H30N4O2S/c1-16-6-5-7-18(12-16)28-21(30)15-32-23-20(14-27)25(19(13-26)22(31)29-23)10-8-17(9-11-25)24(2,3)4/h5-7,12,17,19H,8-11,15H2,1-4H3,(H,28,30)(H,29,31)