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

Systemtic Name: 1-butyl-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-butyl-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-butyl-1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-butyl-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 3-benzyl-1-butyl-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O/c1-3-4-15-28(25(29)26-18-22-11-6-5-7-12-22)20-24-14-9-16-27(24)19-23-13-8-10-21(2)17-23/h5-14,16-17H,3-4,15,18-20H2,1-2H3,(H,26,29)