1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(phenylmethyl)urea

Systemtic Name: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexyl-urea CAS Name: 1-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-1-cyclohexyl-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-1-cyclohexylurea Traditional Name: 3-benzyl-1-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-1-cyclohexyl-urea Formula: C26H30ClN3O MolecularWeight: 435.9889

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H30ClN3O/c27-23-12-7-11-22(17-23)19-29-16-8-15-25(29)20-30(24-13-5-2-6-14-24)26(31)28-18-21-9-3-1-4-10-21/h1,3-4,7-12,15-17,24H,2,5-6,13-14,18-20H2,(H,28,31)