3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-(phenylmethyl)urea

Systemtic Name: 3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-tert-butyl-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-tert-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-benzyl-3-tert-butyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]urea Formula: C25H31N3O MolecularWeight: 389.53314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)NC(C)(C)C

InChI

InChI=1S/C25H31N3O/c1-20-11-8-9-14-22(20)18-27-16-10-15-23(27)19-28(24(29)26-25(2,3)4)17-21-12-6-5-7-13-21/h5-16H,17-19H2,1-4H3,(H,26,29)