1-[3-[[1-butyl-3-(2-methylpropyl)-5-propyl-pyrrol-2-yl]methyl]phenyl]urea

Systemtic Name: 1-[3-[[1-butyl-3-(2-methylpropyl)-5-propyl-pyrrol-2-yl]methyl]phenyl]urea Openeye Name: [3-[(1-butyl-3-isobutyl-5-propyl-pyrrol-2-yl)methyl]phenyl]urea CAS Name: [3-[[1-butyl-3-(2-methylpropyl)-5-propyl-2-pyrrolyl]methyl]phenyl]urea IUPAC Name: [3-[[1-butyl-3-(2-methylpropyl)-5-propylpyrrol-2-yl]methyl]phenyl]urea Traditional Name: [3-[(1-butyl-3-isobutyl-5-propyl-pyrrol-2-yl)methyl]phenyl]urea Formula: C23H35N3O MolecularWeight: 369.5435

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=C1CC2=CC(=CC=C2)NC(=O)N)CC(C)C)CCC

Isomeric SMILES

CCCCN1C(=CC(=C1CC2=CC(=CC=C2)NC(=O)N)CC(C)C)CCC

InChI

InChI=1S/C23H35N3O/c1-5-7-12-26-21(9-6-2)16-19(13-17(3)4)22(26)15-18-10-8-11-20(14-18)25-23(24)27/h8,10-11,14,16-17H,5-7,9,12-13,15H2,1-4H3,(H3,24,25,27)