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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=CC=C3C

Isomeric SMILES

CCCCNC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=CC=C3C

InChI

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