3-(3-methoxyphenyl)-1-pentyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 3-(3-methoxyphenyl)-1-pentyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(3-methoxyphenyl)-1-pentyl-urea CAS Name: 3-(3-methoxyphenyl)-1-pentyl-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(3-methoxyphenyl)-1-pentylurea Traditional Name: 1-amyl-1-[(1-benzylpyrrol-2-yl)methyl]-3-(3-methoxyphenyl)urea Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O2/c1-3-4-8-16-28(25(29)26-22-13-9-15-24(18-22)30-2)20-23-14-10-17-27(23)19-21-11-6-5-7-12-21/h5-7,9-15,17-18H,3-4,8,16,19-20H2,1-2H3,(H,26,29)