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

Systemtic Name: 1-butyl-3-naphthalen-1-yl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(1-naphthyl)urea CAS Name: 1-butyl-3-(1-naphthalenyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-naphthalen-1-ylurea Traditional Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butyl-3-(1-naphthyl)urea Formula: C27H29N3O MolecularWeight: 411.53866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H29N3O/c1-2-3-18-30(21-24-15-10-19-29(24)20-22-11-5-4-6-12-22)27(31)28-26-17-9-14-23-13-7-8-16-25(23)26/h4-17,19H,2-3,18,20-21H2,1H3,(H,28,31)