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

Systemtic Name: 1-butyl-1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-yl-urea Openeye Name: 1-butyl-1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(1-naphthyl)urea CAS Name: 1-butyl-1-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-3-(1-naphthalenyl)urea IUPAC Name: 1-butyl-1-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-ylurea Traditional Name: 1-butyl-1-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-3-(1-naphthyl)urea Formula: C27H28ClN3O MolecularWeight: 445.98372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H28ClN3O/c1-2-3-17-31(27(32)29-26-16-8-12-21-10-4-6-14-24(21)26)20-23-13-9-18-30(23)19-22-11-5-7-15-25(22)28/h4-16,18H,2-3,17,19-20H2,1H3,(H,29,32)