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

Systemtic Name: 4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]benzamide CAS Name: 4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-tert-butyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]benzamide Traditional Name: N-benzyl-4-tert-butyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]benzamide Formula: C30H31FN2O MolecularWeight: 454.578343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CN3CC4=CC(=CC=C4)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)CC3=CC=CN3CC4=CC(=CC=C4)F

InChI

InChI=1S/C30H31FN2O/c1-30(2,3)26-16-14-25(15-17-26)29(34)33(20-23-9-5-4-6-10-23)22-28-13-8-18-32(28)21-24-11-7-12-27(31)19-24/h4-19H,20-22H2,1-3H3