N-(1H-benzimidazol-2-ylmethyl)-1-[(2,4-dichlorophenyl)methyl]-4-(2-hydroxyethylsulfanyl)pyrrolidine-2-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(2,4-dichlorophenyl)methyl]-4-(2-hydroxyethylsulfanyl)pyrrolidine-2-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(2,4-dichlorophenyl)methyl]-4-(2-hydroxyethylsulfanyl)pyrrolidine-2-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(2,4-dichlorophenyl)methyl]-4-(2-hydroxyethylthio)-2-pyrrolidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-1-[(2,4-dichlorophenyl)methyl]-4-(2-hydroxyethylsulfanyl)pyrrolidine-2-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-1-(2,4-dichlorobenzyl)-4-(2-hydroxyethylthio)pyrrolidine-2-carboxamide Formula: C22H24Cl2N4O2S MolecularWeight: 479.42256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCC2=NC3=CC=CC=C3N2)CC4=C(C=C(C=C4)Cl)Cl)SCCO

Isomeric SMILES

C1C(CN(C1C(=O)NCC2=NC3=CC=CC=C3N2)CC4=C(C=C(C=C4)Cl)Cl)SCCO

InChI

InChI=1S/C22H24Cl2N4O2S/c23-15-6-5-14(17(24)9-15)12-28-13-16(31-8-7-29)10-20(28)22(30)25-11-21-26-18-3-1-2-4-19(18)27-21/h1-6,9,16,20,29H,7-8,10-13H2,(H,25,30)(H,26,27)