N-butyl-4-(2,3-dimethoxyphenyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxamide

Systemtic Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-3-carboxamide Openeye Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxamide CAS Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-[oxo(thiophen-2-yl)methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(thiophene-2-carbonyl)pyrrolidine-3-carboxamide Traditional Name: N-butyl-4-(2,3-dimethoxyphenyl)-1-(2-thenoyl)pyrrolidine-3-carboxamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CN(CC1C2=C(C(=CC=C2)OC)OC)C(=O)C3=CC=CS3

Isomeric SMILES

CCCCNC(=O)C1CN(CC1C2=C(C(=CC=C2)OC)OC)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H28N2O4S/c1-4-5-11-23-21(25)17-14-24(22(26)19-10-7-12-29-19)13-16(17)15-8-6-9-18(27-2)20(15)28-3/h6-10,12,16-17H,4-5,11,13-14H2,1-3H3,(H,23,25)