N-butyl-N-[2-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-benzamide

Systemtic Name: N-butyl-N-[2-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-phenyl-benzamide Openeye Name: N-[2-[benzyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]-N-butyl-4-phenyl-benzamide CAS Name: N-butyl-N-[2-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl-(phenylmethyl)amino]-2-oxoethyl]-4-phenylbenzamide IUPAC Name: N-[2-[benzyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxoethyl]-N-butyl-4-phenylbenzamide Traditional Name: N-[2-[benzyl-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]amino]-2-keto-ethyl]-N-butyl-4-phenyl-benzamide Formula: C38H38FN3O2 MolecularWeight: 587.725623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=C(C=C3)F)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C38H38FN3O2/c1-2-3-24-41(38(44)34-20-18-33(19-21-34)32-13-8-5-9-14-32)29-37(43)42(27-30-11-6-4-7-12-30)28-36-15-10-25-40(36)26-31-16-22-35(39)23-17-31/h4-23,25H,2-3,24,26-29H2,1H3