N-(4-bromophenyl)-2-[(7,11-dicyano-8-oxidanylidene-3-phenyl-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[(7,11-dicyano-8-oxidanylidene-3-phenyl-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[(7,11-dicyano-8-oxo-3-phenyl-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]acetamide CAS Name: N-(4-bromophenyl)-2-[(7,11-dicyano-8-oxo-3-phenyl-9-azaspiro[5.5]undec-10-en-10-yl)thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[(7,11-dicyano-8-oxo-3-phenyl-9-azaspiro[5.5]undec-10-en-10-yl)sulfanyl]acetamide Traditional Name: N-(4-bromophenyl)-2-[(7,11-dicyano-8-keto-3-phenyl-9-azaspiro[5.5]undec-10-en-10-yl)thio]acetamide Formula: C26H23BrN4O2S MolecularWeight: 535.45542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C3=CC=CC=C3)C(C(=O)NC(=C2C#N)SCC(=O)NC4=CC=C(C=C4)Br)C#N

Isomeric SMILES

C1CC2(CCC1C3=CC=CC=C3)C(C(=O)NC(=C2C#N)SCC(=O)NC4=CC=C(C=C4)Br)C#N

InChI

InChI=1S/C26H23BrN4O2S/c27-19-6-8-20(9-7-19)30-23(32)16-34-25-22(15-29)26(21(14-28)24(33)31-25)12-10-18(11-13-26)17-4-2-1-3-5-17/h1-9,18,21H,10-13,16H2,(H,30,32)(H,31,33)