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

Systemtic Name: 1-butyl-3-(4-ethoxyphenyl)-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-butyl-3-(4-ethoxyphenyl)-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-butyl-3-(4-ethoxyphenyl)-1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-butyl-3-(4-ethoxyphenyl)-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-butyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-p-phenetyl-urea Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C26H33N3O2/c1-4-6-17-29(26(30)27-23-13-15-25(16-14-23)31-5-2)20-24-12-9-18-28(24)19-22-11-8-7-10-21(22)3/h7-16,18H,4-6,17,19-20H2,1-3H3,(H,27,30)