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

Systemtic Name: 1-cyclohexyl-3-(3-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-cyclohexyl-3-(m-tolyl)-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-cyclohexyl-3-(3-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-cyclohexyl-3-(3-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-cyclohexyl-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-(m-tolyl)urea Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)NC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)NC4=CC=CC(=C4)C

InChI

InChI=1S/C27H33N3O/c1-21-9-6-11-23(17-21)19-29-16-8-15-26(29)20-30(25-13-4-3-5-14-25)27(31)28-24-12-7-10-22(2)18-24/h6-12,15-18,25H,3-5,13-14,19-20H2,1-2H3,(H,28,31)