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

Systemtic Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-phenyl-urea Openeye Name: 1-butyl-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-3-phenyl-urea CAS Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-phenylurea IUPAC Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-phenylurea Traditional Name: 1-butyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-phenyl-urea Formula: C24H29N3O MolecularWeight: 375.50656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O/c1-3-4-16-27(24(28)25-22-13-6-5-7-14-22)19-23-15-10-17-26(23)18-21-12-9-8-11-20(21)2/h5-15,17H,3-4,16,18-19H2,1-2H3,(H,25,28)