5-butyl-1-[(2-methoxyphenyl)methyl]-2-methyl-4-thiophen-3-yl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-[(2-methoxyphenyl)methyl]-2-methyl-4-thiophen-3-yl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[(2-methoxyphenyl)methyl]-2-methyl-4-(3-thienyl)pyrrole-3-carboxamide CAS Name: 5-butyl-1-[(2-methoxyphenyl)methyl]-2-methyl-4-(3-thiophenyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[(2-methoxyphenyl)methyl]-2-methyl-4-thiophen-3-ylpyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-1-o-anisyl-4-(3-thienyl)pyrrole-3-carboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC=CC=C2OC)C)C(=O)N)C3=CSC=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC=CC=C2OC)C)C(=O)N)C3=CSC=C3

InChI

InChI=1S/C22H26N2O2S/c1-4-5-9-18-21(17-11-12-27-14-17)20(22(23)25)15(2)24(18)13-16-8-6-7-10-19(16)26-3/h6-8,10-12,14H,4-5,9,13H2,1-3H3,(H2,23,25)