(8-azaniumyl-7-cyano-10-sulfanylidene-9-azaspiro[5.5]undec-7-en-11-ylidene)-azanyl-methanolate

Systemtic Name: (8-azaniumyl-7-cyano-10-sulfanylidene-9-azaspiro[5.5]undec-7-en-11-ylidene)-azanyl-methanolate Openeye Name: amino-(8-azaniumyl-7-cyano-10-thioxo-9-azaspiro[5.5]undec-7-en-11-ylidene)methanolate CAS Name: amino-(8-ammonio-7-cyano-10-sulfanylidene-9-azaspiro[5.5]undec-7-en-11-ylidene)methanolate IUPAC Name: amino-(8-azaniumyl-7-cyano-10-sulfanylidene-9-azaspiro[5.5]undec-7-en-11-ylidene)methanolate Traditional Name: amino-(8-ammonio-7-cyano-10-thioxo-9-azaspiro[5.5]undec-7-en-11-ylidene)methanolate Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(=C(NC(=S)C2=C(N)[O-])[NH3+])C#N

Isomeric SMILES

C1CCC2(CC1)C(=C(NC(=S)C2=C(N)[O-])[NH3+])C#N

InChI

InChI=1S/C12H16N4OS/c13-6-7-9(14)16-11(18)8(10(15)17)12(7)4-2-1-3-5-12/h17H,1-5,14-15H2,(H,16,18)