8-azanyl-10-(phenylmethylsulfanyl)-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile

Systemtic Name: 8-azanyl-10-(phenylmethylsulfanyl)-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Openeye Name: 8-amino-10-benzylsulfanyl-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile CAS Name: 8-amino-10-(phenylmethylthio)-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile IUPAC Name: 8-amino-10-benzylsulfanyl-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Traditional Name: 8-amino-10-(benzylthio)-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Formula: C19H20N4S MolecularWeight: 336.4539

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(=NC(=C2C#N)SCC3=CC=CC=C3)N)C#N

Isomeric SMILES

C1CCC2(CC1)C(C(=NC(=C2C#N)SCC3=CC=CC=C3)N)C#N

InChI

InChI=1S/C19H20N4S/c20-11-15-17(22)23-18(24-13-14-7-3-1-4-8-14)16(12-21)19(15)9-5-2-6-10-19/h1,3-4,7-8,15H,2,5-6,9-10,13H2,(H2,22,23)