3-(4-bromophenyl)-1-butyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 3-(4-bromophenyl)-1-butyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(4-bromophenyl)-1-butyl-urea CAS Name: 3-(4-bromophenyl)-1-butyl-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(4-bromophenyl)-1-butylurea Traditional Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(4-bromophenyl)-1-butyl-urea Formula: C23H26BrN3O MolecularWeight: 440.37604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C23H26BrN3O/c1-2-3-15-27(23(28)25-21-13-11-20(24)12-14-21)18-22-10-7-16-26(22)17-19-8-5-4-6-9-19/h4-14,16H,2-3,15,17-18H2,1H3,(H,25,28)