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

Systemtic Name: 1-butyl-3-(phenylmethyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 3-benzyl-1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-urea CAS Name: 1-butyl-3-(phenylmethyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 3-benzyl-1-[(1-benzylpyrrol-2-yl)methyl]-1-butylurea Traditional Name: 3-benzyl-1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-urea Formula: C24H29N3O MolecularWeight: 375.50656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O/c1-2-3-16-27(24(28)25-18-21-11-6-4-7-12-21)20-23-15-10-17-26(23)19-22-13-8-5-9-14-22/h4-15,17H,2-3,16,18-20H2,1H3,(H,25,28)