N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)-3-(3,4,5-trimethoxyphenyl)propanamide

Systemtic Name: N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)-3-(3,4,5-trimethoxyphenyl)propanamide Openeye Name: N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide CAS Name: N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-3-(3,4,5-trimethoxyphenyl)propanamide IUPAC Name: N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)-3-(3,4,5-trimethoxyphenyl)propanamide Traditional Name: N-[2-pyrrolidino-2-(2-thienyl)ethyl]-3-(3,4,5-trimethoxyphenyl)propionamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)NCC(C2=CC=CS2)N3CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)NCC(C2=CC=CS2)N3CCCC3

InChI

InChI=1S/C22H30N2O4S/c1-26-18-13-16(14-19(27-2)22(18)28-3)8-9-21(25)23-15-17(20-7-6-12-29-20)24-10-4-5-11-24/h6-7,12-14,17H,4-5,8-11,15H2,1-3H3,(H,23,25)