10-oxidanylidene-11-phenacyl-8-sulfanyl-9-azaspiro[5.5]undec-7-ene-7,11-dicarbonitrile

Systemtic Name: 10-oxidanylidene-11-phenacyl-8-sulfanyl-9-azaspiro[5.5]undec-7-ene-7,11-dicarbonitrile Openeye Name: 10-oxo-11-phenacyl-8-sulfanyl-9-azaspiro[5.5]undec-7-ene-7,11-dicarbonitrile CAS Name: 8-mercapto-10-oxo-11-phenacyl-9-azaspiro[5.5]undec-7-ene-7,11-dicarbonitrile IUPAC Name: 10-oxo-11-phenacyl-8-sulfanyl-9-azaspiro[5.5]undec-7-ene-7,11-dicarbonitrile Traditional Name: 10-keto-8-mercapto-11-phenacyl-9-azaspiro[5.5]undec-7-ene-7,11-dicarbonitrile Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(=C(NC(=O)C2(CC(=O)C3=CC=CC=C3)C#N)S)C#N

Isomeric SMILES

C1CCC2(CC1)C(=C(NC(=O)C2(CC(=O)C3=CC=CC=C3)C#N)S)C#N

InChI

InChI=1S/C20H19N3O2S/c21-12-15-17(26)23-18(25)20(13-22,19(15)9-5-2-6-10-19)11-16(24)14-7-3-1-4-8-14/h1,3-4,7-8,26H,2,5-6,9-11H2,(H,23,25)