2,5-dimethyl-1-(3-methylbutyl)-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-1-(3-methylbutyl)-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide Openeye Name: 1-isopentyl-2,5-dimethyl-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-1-(3-methylbutyl)-4-[4-(1-pyrrolidinyl)phenyl]-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-1-(3-methylbutyl)-4-(4-pyrrolidin-1-ylphenyl)pyrrole-3-carboxamide Traditional Name: 1-isoamyl-2,5-dimethyl-4-(4-pyrrolidinophenyl)pyrrole-3-carboxamide Formula: C22H31N3O MolecularWeight: 353.50104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)N3CCCC3

Isomeric SMILES

CC1=C(C(=C(N1CCC(C)C)C)C(=O)N)C2=CC=C(C=C2)N3CCCC3

InChI

InChI=1S/C22H31N3O/c1-15(2)11-14-25-16(3)20(21(17(25)4)22(23)26)18-7-9-19(10-8-18)24-12-5-6-13-24/h7-10,15H,5-6,11-14H2,1-4H3,(H2,23,26)