4-(4-cyanophenyl)-1-(3,3-dimethylbutyl)-2-methyl-5-propyl-pyrrole-3-carboxamide

Systemtic Name: 4-(4-cyanophenyl)-1-(3,3-dimethylbutyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Openeye Name: 4-(4-cyanophenyl)-1-(3,3-dimethylbutyl)-2-methyl-5-propyl-pyrrole-3-carboxamide CAS Name: 4-(4-cyanophenyl)-1-(3,3-dimethylbutyl)-2-methyl-5-propyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-cyanophenyl)-1-(3,3-dimethylbutyl)-2-methyl-5-propylpyrrole-3-carboxamide Traditional Name: 4-(4-cyanophenyl)-1-(3,3-dimethylbutyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Formula: C22H29N3O MolecularWeight: 351.48516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CCC(C)(C)C)C)C(=O)N)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCCC1=C(C(=C(N1CCC(C)(C)C)C)C(=O)N)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H29N3O/c1-6-7-18-20(17-10-8-16(14-23)9-11-17)19(21(24)26)15(2)25(18)13-12-22(3,4)5/h8-11H,6-7,12-13H2,1-5H3,(H2,24,26)