1-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-ethoxyphenyl)urea

Systemtic Name: 1-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-ethoxyphenyl)urea Openeye Name: 1-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-ethoxyphenyl)urea CAS Name: 1-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-1-cyclohexyl-3-(4-ethoxyphenyl)urea IUPAC Name: 1-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(4-ethoxyphenyl)urea Traditional Name: 1-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-1-cyclohexyl-3-p-phenetyl-urea Formula: C27H32BrN3O2 MolecularWeight: 510.46588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)N(CC2=CC=CN2CC3=CC=C(C=C3)Br)C4CCCCC4

InChI

InChI=1S/C27H32BrN3O2/c1-2-33-26-16-14-23(15-17-26)29-27(32)31(24-7-4-3-5-8-24)20-25-9-6-18-30(25)19-21-10-12-22(28)13-11-21/h6,9-18,24H,2-5,7-8,19-20H2,1H3,(H,29,32)