1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1,3-bis(phenylmethyl)urea

Systemtic Name: 1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1,3-bis(phenylmethyl)urea Openeye Name: 1,3-dibenzyl-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-1,3-bis(phenylmethyl)urea IUPAC Name: 1,3-dibenzyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1,3-dibenzyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C28H29N3O MolecularWeight: 423.54936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H29N3O/c1-23-11-8-9-16-26(23)21-30-18-10-17-27(30)22-31(20-25-14-6-3-7-15-25)28(32)29-19-24-12-4-2-5-13-24/h2-18H,19-22H2,1H3,(H,29,32)