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

Systemtic Name: 8-azanyl-7-cyano-10-(phenylmethylsulfanyl)-9-azaspiro[5.5]undeca-8,10-diene-11-carboxamide Openeye Name: 8-amino-10-benzylsulfanyl-7-cyano-9-azaspiro[5.5]undeca-8,10-diene-11-carboxamide CAS Name: 8-amino-7-cyano-10-(phenylmethylthio)-9-azaspiro[5.5]undeca-8,10-diene-11-carboxamide IUPAC Name: 8-amino-10-benzylsulfanyl-7-cyano-9-azaspiro[5.5]undeca-8,10-diene-11-carboxamide Traditional Name: 8-amino-10-(benzylthio)-7-cyano-9-azaspiro[5.5]undeca-8,10-diene-11-carboxamide Formula: C19H22N4OS MolecularWeight: 354.46918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4OS/c20-11-14-16(21)23-18(25-12-13-7-3-1-4-8-13)15(17(22)24)19(14)9-5-2-6-10-19/h1,3-4,7-8,14H,2,5-6,9-10,12H2,(H2,21,23)(H2,22,24)