1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-yl-1-pentyl-urea

Systemtic Name: 1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-yl-1-pentyl-urea Openeye Name: 3-(1-naphthyl)-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-1-pentyl-urea CAS Name: 1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-(1-naphthalenyl)-1-pentylurea IUPAC Name: 1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-yl-1-pentylurea Traditional Name: 1-amyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-(1-naphthyl)urea Formula: C29H33N3O MolecularWeight: 439.59182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H33N3O/c1-3-4-9-19-32(29(33)30-28-18-10-15-24-13-7-8-17-27(24)28)22-26-16-11-20-31(26)21-25-14-6-5-12-23(25)2/h5-8,10-18,20H,3-4,9,19,21-22H2,1-2H3,(H,30,33)