8-azanyl-10-[(3-methoxyphenyl)methylsulfanyl]-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile

Systemtic Name: 8-azanyl-10-[(3-methoxyphenyl)methylsulfanyl]-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Openeye Name: 8-amino-10-[(3-methoxyphenyl)methylsulfanyl]-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile CAS Name: 8-amino-10-[(3-methoxyphenyl)methylthio]-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile IUPAC Name: 8-amino-10-[(3-methoxyphenyl)methylsulfanyl]-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Traditional Name: 8-amino-10-(m-anisylthio)-9-azaspiro[5.5]undeca-8,10-diene-7,11-dicarbonitrile Formula: C20H22N4OS MolecularWeight: 366.47988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=C(C3(CCCCC3)C(C(=N2)N)C#N)C#N

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=C(C3(CCCCC3)C(C(=N2)N)C#N)C#N

InChI

InChI=1S/C20H22N4OS/c1-25-15-7-5-6-14(10-15)13-26-19-17(12-22)20(8-3-2-4-9-20)16(11-21)18(23)24-19/h5-7,10,16H,2-4,8-9,13H2,1H3,(H2,23,24)