1-butyl-3-(2,4-dimethoxyphenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 1-butyl-3-(2,4-dimethoxyphenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(2,4-dimethoxyphenyl)urea CAS Name: 1-butyl-3-(2,4-dimethoxyphenyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(2,4-dimethoxyphenyl)urea Traditional Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(2,4-dimethoxyphenyl)urea Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3/c1-4-5-15-28(25(29)26-23-14-13-22(30-2)17-24(23)31-3)19-21-12-9-16-27(21)18-20-10-7-6-8-11-20/h6-14,16-17H,4-5,15,18-19H2,1-3H3,(H,26,29)