N-[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-N-isoquinolin-5-yl-methanesulfonamide

Systemtic Name: N-[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-N-isoquinolin-5-yl-methanesulfonamide Openeye Name: N-[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-N-(5-isoquinolyl)methanesulfonamide CAS Name: N-[1-[bis(4-chlorophenyl)methyl]-3-azetidinyl]-N-(5-isoquinolinyl)methanesulfonamide IUPAC Name: N-[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-N-isoquinolin-5-ylmethanesulfonamide Traditional Name: N-[1-[bis(4-chlorophenyl)methyl]azetidin-3-yl]-N-(5-isoquinolyl)methanesulfonamide Formula: C26H23Cl2N3O2S MolecularWeight: 512.45072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

CS(=O)(=O)N(C1CN(C1)C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C26H23Cl2N3O2S/c1-34(32,33)31(25-4-2-3-20-15-29-14-13-24(20)25)23-16-30(17-23)26(18-5-9-21(27)10-6-18)19-7-11-22(28)12-8-19/h2-15,23,26H,16-17H2,1H3