4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-propyl-benzamide

Systemtic Name: 4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-propyl-benzamide Openeye Name: 4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-propyl-benzamide CAS Name: 4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-propylbenzamide IUPAC Name: 4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-propylbenzamide Traditional Name: 4-tert-butyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-N-propyl-benzamide Formula: C26H31FN2O MolecularWeight: 406.535543

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H31FN2O/c1-5-15-29(25(30)21-11-13-22(14-12-21)26(2,3)4)19-24-10-7-16-28(24)18-20-8-6-9-23(27)17-20/h6-14,16-17H,5,15,18-19H2,1-4H3