(7R)-7,11-dicyano-3-ethanoyl-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate

Systemtic Name: (7R)-7,11-dicyano-3-ethanoyl-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Openeye Name: (7R)-3-acetyl-7,11-dicyano-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate CAS Name: (7R)-3-acetyl-7,11-dicyano-10-mercapto-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate IUPAC Name: (7R)-3-acetyl-7,11-dicyano-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Traditional Name: (7R)-3-acetyl-7,11-dicyano-10-mercapto-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Formula: C13H13N4O2S- MolecularWeight: 289.33292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2(CC1)C(C(=NC(=C2C#N)S)[O-])C#N

Isomeric SMILES

CC(=O)N1CCC2(CC1)[C@@H](C(=NC(=C2C#N)S)[O-])C#N

InChI

InChI=1S/C13H14N4O2S/c1-8(18)17-4-2-13(3-5-17)9(6-14)11(19)16-12(20)10(13)7-15/h9,20H,2-5H2,1H3,(H,16,19)/p-1/t9-/m1/s1