2-cyclopropyl-N-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]methyl]-N-(pyridin-3-ylmethyl)-1,3-benzoxazole-6-carboxamide

Systemtic Name: 2-cyclopropyl-N-[[(2S)-5-oxidanylidenepyrrolidin-2-yl]methyl]-N-(pyridin-3-ylmethyl)-1,3-benzoxazole-6-carboxamide Openeye Name: 2-cyclopropyl-N-[[(2S)-5-oxopyrrolidin-2-yl]methyl]-N-(3-pyridylmethyl)-1,3-benzoxazole-6-carboxamide CAS Name: 2-cyclopropyl-N-[[(2S)-5-oxo-2-pyrrolidinyl]methyl]-N-(3-pyridinylmethyl)-1,3-benzoxazole-6-carboxamide IUPAC Name: 2-cyclopropyl-N-[[(2S)-5-oxopyrrolidin-2-yl]methyl]-N-(pyridin-3-ylmethyl)-1,3-benzoxazole-6-carboxamide Traditional Name: 2-cyclopropyl-N-[[(2S)-5-ketopyrrolidin-2-yl]methyl]-N-(3-pyridylmethyl)-1,3-benzoxazole-6-carboxamide Formula: C22H22N4O3 MolecularWeight: 390.43508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(O2)C=C(C=C3)C(=O)N(CC4CCC(=O)N4)CC5=CN=CC=C5

Isomeric SMILES

C1CC(=O)N[C@@H]1CN(CC2=CN=CC=C2)C(=O)C3=CC4=C(C=C3)N=C(O4)C5CC5

InChI

InChI=1S/C22H22N4O3/c27-20-8-6-17(24-20)13-26(12-14-2-1-9-23-11-14)22(28)16-5-7-18-19(10-16)29-21(25-18)15-3-4-15/h1-2,5,7,9-11,15,17H,3-4,6,8,12-13H2,(H,24,27)/t17-/m0/s1