3-(4-ethoxyphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea

Systemtic Name: 3-(4-ethoxyphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea Openeye Name: 3-(4-ethoxyphenyl)-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]-1-pentyl-urea CAS Name: 3-(4-ethoxyphenyl)-1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-1-pentylurea IUPAC Name: 3-(4-ethoxyphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-pentylurea Traditional Name: 1-amyl-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-p-phenetyl-urea Formula: C27H35N3O2 MolecularWeight: 433.5857

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=CC(=C2)C)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=CC(=C2)C)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C27H35N3O2/c1-4-6-7-17-30(27(31)28-24-13-15-26(16-14-24)32-5-2)21-25-12-9-18-29(25)20-23-11-8-10-22(3)19-23/h8-16,18-19H,4-7,17,20-21H2,1-3H3,(H,28,31)