8-azanyl-3-ethyl-10-sulfanyl-9-aza-3-azoniaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile

Systemtic Name: 8-azanyl-3-ethyl-10-sulfanyl-9-aza-3-azoniaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Openeye Name: 8-amino-3-ethyl-10-sulfanyl-9-aza-3-azoniaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile CAS Name: 8-amino-3-ethyl-10-mercapto-9-aza-3-azoniaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile IUPAC Name: 8-amino-3-ethyl-10-sulfanyl-9-aza-3-azoniaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Traditional Name: 8-amino-3-ethyl-10-mercapto-9-aza-3-azoniaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Formula: C13H18N5S+ MolecularWeight: 276.38052

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC2(CC1)C(C(=NC(=C2C#N)S)N)C#N

Isomeric SMILES

CC[NH+]1CCC2(CC1)C(C(=NC(=C2C#N)S)N)C#N

InChI

InChI=1S/C13H17N5S/c1-2-18-5-3-13(4-6-18)9(7-14)11(16)17-12(19)10(13)8-15/h9,19H,2-6H2,1H3,(H2,16,17)/p+1