1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-thiophen-3-yl-pyrrole-3-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-thiophen-3-yl-pyrrole-3-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-(3-thienyl)pyrrole-3-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-(3-thiophenyl)-3-pyrrolecarboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-thiophen-3-ylpyrrole-3-carboxamide Traditional Name: 5-ethyl-1-homoveratryl-2-methyl-4-(3-thienyl)pyrrole-3-carboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CSC=C3

Isomeric SMILES

CCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=CSC=C3

InChI

InChI=1S/C22H26N2O3S/c1-5-17-21(16-9-11-28-13-16)20(22(23)25)14(2)24(17)10-8-15-6-7-18(26-3)19(12-15)27-4/h6-7,9,11-13H,5,8,10H2,1-4H3,(H2,23,25)