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

Systemtic Name: N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-4-tert-butyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-4-tert-butyl-benzamide CAS Name: N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-4-tert-butyl-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-4-tert-butylbenzamide Traditional Name: N-benzyl-N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-4-tert-butyl-benzamide Formula: C30H31BrN2O MolecularWeight: 515.48394

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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=C(C=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C30H31BrN2O/c1-30(2,3)26-15-13-25(14-16-26)29(34)33(21-23-8-5-4-6-9-23)22-28-10-7-19-32(28)20-24-11-17-27(31)18-12-24/h4-19H,20-22H2,1-3H3