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

Systemtic Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-benzamide Openeye Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-benzamide CAS Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-4-methylbenzamide IUPAC Name: N-cyclohexyl-N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-4-methylbenzamide Traditional Name: N-cyclohexyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-4-methyl-benzamide Formula: C26H29FN2O MolecularWeight: 404.519663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)F)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)F)C4CCCCC4

InChI

InChI=1S/C26H29FN2O/c1-20-12-14-22(15-13-20)26(30)29(24-9-3-2-4-10-24)19-25-11-6-16-28(25)18-21-7-5-8-23(27)17-21/h5-8,11-17,24H,2-4,9-10,18-19H2,1H3