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

Systemtic Name: (7S)-7,11-dicyano-3-ethoxycarbonyl-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Openeye Name: (7S)-7,11-dicyano-3-ethoxycarbonyl-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate CAS Name: (7S)-7,11-dicyano-3-ethoxycarbonyl-10-mercapto-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate IUPAC Name: (7S)-7,11-dicyano-3-ethoxycarbonyl-10-sulfanyl-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Traditional Name: (7S)-3-carbethoxy-7,11-dicyano-10-mercapto-3,9-diazaspiro[5.5]undeca-8,10-dien-8-olate Formula: C14H15N4O3S- MolecularWeight: 319.3589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O3S/c1-2-21-13(20)18-5-3-14(4-6-18)9(7-15)11(19)17-12(22)10(14)8-16/h9,22H,2-6H2,1H3,(H,17,19)/p-1/t9-/m0/s1