N-[4-(azetidin-1-yl)-2-propyl-quinolin-6-yl]-4-(4-chlorophenyl)pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(azetidin-1-yl)-2-propyl-quinolin-6-yl]-4-(4-chlorophenyl)pyrrolidine-3-carboxamide Openeye Name: N-[4-(azetidin-1-yl)-2-propyl-6-quinolyl]-4-(4-chlorophenyl)pyrrolidine-3-carboxamide CAS Name: N-[4-(1-azetidinyl)-2-propyl-6-quinolinyl]-4-(4-chlorophenyl)-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(azetidin-1-yl)-2-propylquinolin-6-yl]-4-(4-chlorophenyl)pyrrolidine-3-carboxamide Traditional Name: N-[4-(azetidin-1-yl)-2-propyl-6-quinolyl]-4-(4-chlorophenyl)pyrrolidine-3-carboxamide Formula: C26H29ClN4O MolecularWeight: 448.98766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)NC(=O)C3CNCC3C4=CC=C(C=C4)Cl)C(=C1)N5CCC5

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)NC(=O)C3CNCC3C4=CC=C(C=C4)Cl)C(=C1)N5CCC5

InChI

InChI=1S/C26H29ClN4O/c1-2-4-19-14-25(31-11-3-12-31)21-13-20(9-10-24(21)29-19)30-26(32)23-16-28-15-22(23)17-5-7-18(27)8-6-17/h5-10,13-14,22-23,28H,2-4,11-12,15-16H2,1H3,(H,30,32)