N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1-(2-methylpropyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1-(2-methylpropyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-1-isobutyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1-(2-methylpropyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-1-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1-isobutyl-5-keto-pyrrolidine-3-carboxamide Formula: C20H28N4O2S MolecularWeight: 388.52692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CC(CC1=O)C(=O)NC(CCSC)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)CN1CC(CC1=O)C(=O)N[C@@H](CCSC)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C20H28N4O2S/c1-13(2)11-24-12-14(10-18(24)25)20(26)23-17(8-9-27-3)19-21-15-6-4-5-7-16(15)22-19/h4-7,13-14,17H,8-12H2,1-3H3,(H,21,22)(H,23,26)/t14?,17-/m0/s1