11-(2-methoxyphenyl)-8-oxidanylidene-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile

Systemtic Name: 11-(2-methoxyphenyl)-8-oxidanylidene-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile Openeye Name: 11-(2-methoxyphenyl)-8-oxo-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile CAS Name: 10-mercapto-11-(2-methoxyphenyl)-8-oxo-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile IUPAC Name: 11-(2-methoxyphenyl)-8-oxo-10-sulfanyl-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile Traditional Name: 8-keto-10-mercapto-11-(2-methoxyphenyl)-7,11-diazaspiro[5.5]undeca-4,9-diene-9-carbonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=C(C(=O)NC23CCCC=C3)C#N)S

Isomeric SMILES

COC1=CC=CC=C1N2C(=C(C(=O)NC23CCCC=C3)C#N)S

InChI

InChI=1S/C17H17N3O2S/c1-22-14-8-4-3-7-13(14)20-16(23)12(11-18)15(21)19-17(20)9-5-2-6-10-17/h3-5,7-9,23H,2,6,10H2,1H3,(H,19,21)