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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)C4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)Cl)C4CCCCC4

InChI

InChI=1S/C26H30ClN3O/c1-20-9-5-6-15-25(20)28-26(31)30(23-12-3-2-4-13-23)19-24-14-8-16-29(24)18-21-10-7-11-22(27)17-21/h5-11,14-17,23H,2-4,12-13,18-19H2,1H3,(H,28,31)