(10-azanyl-7-cyano-8-sulfanyl-9-azaspiro[5.5]undeca-7,9-dien-11-ylidene)-phenylazanyl-methanolate

Systemtic Name: (10-azanyl-7-cyano-8-sulfanyl-9-azaspiro[5.5]undeca-7,9-dien-11-ylidene)-phenylazanyl-methanolate Openeye Name: (10-amino-7-cyano-8-sulfanyl-9-azaspiro[5.5]undeca-7,9-dien-11-ylidene)-anilino-methanolate CAS Name: (10-amino-7-cyano-8-mercapto-9-azaspiro[5.5]undeca-7,9-dien-11-ylidene)-anilinomethanolate IUPAC Name: (10-amino-7-cyano-8-sulfanyl-9-azaspiro[5.5]undeca-7,9-dien-11-ylidene)-anilinomethanolate Traditional Name: (10-amino-7-cyano-8-mercapto-9-azaspiro[5.5]undeca-7,9-dien-11-ylidene)-anilino-methanolate Formula: C18H19N4OS- MolecularWeight: 339.43466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(=C(N=C(C2=C(NC3=CC=CC=C3)[O-])N)S)C#N

Isomeric SMILES

C1CCC2(CC1)C(=C(N=C(C2=C(NC3=CC=CC=C3)[O-])N)S)C#N

InChI

InChI=1S/C18H20N4OS/c19-11-13-17(24)22-15(20)14(18(13)9-5-2-6-10-18)16(23)21-12-7-3-1-4-8-12/h1,3-4,7-8,21,23-24H,2,5-6,9-10H2,(H2,20,22)/p-1