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

Systemtic Name: N-butyl-4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]benzamide Openeye Name: N-butyl-4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]benzamide CAS Name: N-butyl-4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]benzamide IUPAC Name: N-butyl-4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]benzamide Traditional Name: N-butyl-4-tert-butyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C27H33FN2O MolecularWeight: 420.562123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33FN2O/c1-5-6-16-30(26(31)22-12-14-23(15-13-22)27(2,3)4)20-25-11-8-17-29(25)19-21-9-7-10-24(28)18-21/h7-15,17-18H,5-6,16,19-20H2,1-4H3