5-azanyl-1-cyclooctyl-4-(4-phenyl-1,3-thiazol-2-yl)-2H-pyrrol-3-one

Systemtic Name: 5-azanyl-1-cyclooctyl-4-(4-phenyl-1,3-thiazol-2-yl)-2H-pyrrol-3-one Openeye Name: 5-amino-1-cyclooctyl-4-(4-phenylthiazol-2-yl)-2H-pyrrol-3-one CAS Name: 5-amino-1-cyclooctyl-4-(4-phenyl-2-thiazolyl)-2H-pyrrol-3-one IUPAC Name: 5-amino-1-cyclooctyl-4-(4-phenyl-1,3-thiazol-2-yl)-2H-pyrrol-3-one Traditional Name: 5-amino-1-cyclooctyl-4-(4-phenylthiazol-2-yl)-2-pyrrolin-3-one Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)N2CC(=O)C(=C2N)C3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CCC1)N2CC(=O)C(=C2N)C3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3OS/c22-20-19(21-23-17(14-26-21)15-9-5-4-6-10-15)18(25)13-24(20)16-11-7-2-1-3-8-12-16/h4-6,9-10,14,16H,1-3,7-8,11-13,22H2