3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide

Systemtic Name: 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide Openeye Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanamide CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)-N-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]propanamide IUPAC Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanamide Traditional Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionamide Formula: C20H23N4O3S+ MolecularWeight: 399.48662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@@H]1NC(=O)CCN2C(=O)OC(=N2)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O3S/c25-18(9-11-24-20(26)27-19(22-24)17-7-4-12-28-17)21-16-8-10-23(14-16)13-15-5-2-1-3-6-15/h1-7,12,16H,8-11,13-14H2,(H,21,25)/p+1/t16-/m1/s1