11-(4-methylphenyl)-8-oxidanylidene-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile

Systemtic Name: 11-(4-methylphenyl)-8-oxidanylidene-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile Openeye Name: 8-oxo-11-(p-tolyl)-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile CAS Name: 10-mercapto-11-(4-methylphenyl)-8-oxo-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile IUPAC Name: 11-(4-methylphenyl)-8-oxo-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile Traditional Name: 8-keto-10-mercapto-11-(p-tolyl)-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=O)NC23CCCC=C3)C#N)S

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=O)NC23CCCC=C3)C#N)S

InChI

InChI=1S/C17H17N3OS/c1-12-5-7-13(8-6-12)20-16(22)14(11-18)15(21)19-17(20)9-3-2-4-10-17/h3,5-9,22H,2,4,10H2,1H3,(H,19,21)