N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-4-(2-thienyl)butyramide Formula: C21H26N2O3S MolecularWeight: 386.50774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CCC(=O)C2=CC=CS2)N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)CCC(=O)C2=CC=CS2)N3CCCC3

InChI

InChI=1S/C21H26N2O3S/c1-26-17-7-4-6-16(14-17)18(23-11-2-3-12-23)15-22-21(25)10-9-19(24)20-8-5-13-27-20/h4-8,13-14,18H,2-3,9-12,15H2,1H3,(H,22,25)