3-(3,5-dimethoxyphenyl)-1-pentyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 3-(3,5-dimethoxyphenyl)-1-pentyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(3,5-dimethoxyphenyl)-1-pentyl-urea CAS Name: 3-(3,5-dimethoxyphenyl)-1-pentyl-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(3,5-dimethoxyphenyl)-1-pentylurea Traditional Name: 1-amyl-1-[(1-benzylpyrrol-2-yl)methyl]-3-(3,5-dimethoxyphenyl)urea Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O3/c1-4-5-9-14-29(26(30)27-22-16-24(31-2)18-25(17-22)32-3)20-23-13-10-15-28(23)19-21-11-7-6-8-12-21/h6-8,10-13,15-18H,4-5,9,14,19-20H2,1-3H3,(H,27,30)