1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-propan-2-ylphenyl)urea

Systemtic Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-butyl-3-(4-isopropylphenyl)-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-butyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-p-cumenyl-urea Formula: C27H35N3O MolecularWeight: 417.5863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C27H35N3O/c1-5-6-17-30(27(31)28-25-15-13-23(14-16-25)21(2)3)20-26-12-9-18-29(26)19-24-11-8-7-10-22(24)4/h7-16,18,21H,5-6,17,19-20H2,1-4H3,(H,28,31)