1-(4-bromophenyl)carbonyl-N-(3-cyanophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N-(3-cyanophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: 1-(4-bromobenzoyl)-N-(3-cyanophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N-(3-cyanophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: 1-(4-bromobenzoyl)-N-(3-cyanophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: 1-(4-bromobenzoyl)-N-(3-cyanophenyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carboxamide Formula: C22H21BrN4O2S MolecularWeight: 485.39674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N(CCS2)C(=O)C3=CC=C(C=C3)Br)C(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC12N(CCS2)C(=O)C3=CC=C(C=C3)Br)C(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H21BrN4O2S/c23-18-6-4-17(5-7-18)20(28)27-12-13-30-22(27)8-10-26(11-9-22)21(29)25-19-3-1-2-16(14-19)15-24/h1-7,14H,8-13H2,(H,25,29)