7-azanyl-6-cyano-9-(phenylmethylsulfanyl)-8-azaspiro[4.5]deca-7,9-diene-10-carboxamide

Systemtic Name: 7-azanyl-6-cyano-9-(phenylmethylsulfanyl)-8-azaspiro[4.5]deca-7,9-diene-10-carboxamide Openeye Name: 7-amino-9-benzylsulfanyl-6-cyano-8-azaspiro[4.5]deca-7,9-diene-10-carboxamide CAS Name: 7-amino-6-cyano-9-(phenylmethylthio)-8-azaspiro[4.5]deca-7,9-diene-10-carboxamide IUPAC Name: 7-amino-9-benzylsulfanyl-6-cyano-8-azaspiro[4.5]deca-7,9-diene-10-carboxamide Traditional Name: 7-amino-9-(benzylthio)-6-cyano-8-azaspiro[4.5]deca-7,9-diene-10-carboxamide Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C(C(=NC(=C2C(=O)N)SCC3=CC=CC=C3)N)C#N

Isomeric SMILES

C1CCC2(C1)C(C(=NC(=C2C(=O)N)SCC3=CC=CC=C3)N)C#N

InChI

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