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

Systemtic Name: 1-[3-[[1-butyl-5-(2-methylpropyl)pyrrol-2-yl]methyl]phenyl]urea Openeye Name: [3-[(1-butyl-5-isobutyl-pyrrol-2-yl)methyl]phenyl]urea CAS Name: [3-[[1-butyl-5-(2-methylpropyl)-2-pyrrolyl]methyl]phenyl]urea IUPAC Name: [3-[[1-butyl-5-(2-methylpropyl)pyrrol-2-yl]methyl]phenyl]urea Traditional Name: [3-[(1-butyl-5-isobutyl-pyrrol-2-yl)methyl]phenyl]urea Formula: C20H29N3O MolecularWeight: 327.46376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC=C1CC(C)C)CC2=CC(=CC=C2)NC(=O)N

Isomeric SMILES

CCCCN1C(=CC=C1CC(C)C)CC2=CC(=CC=C2)NC(=O)N

InChI

InChI=1S/C20H29N3O/c1-4-5-11-23-18(12-15(2)3)9-10-19(23)14-16-7-6-8-17(13-16)22-20(21)24/h6-10,13,15H,4-5,11-12,14H2,1-3H3,(H3,21,22,24)