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

Systemtic Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Openeye Name: 1-butyl-3-(4-nitrophenyl)-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-butyl-1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Traditional Name: 1-butyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H28N4O3/c1-3-4-15-27(24(29)25-21-11-13-22(14-12-21)28(30)31)18-23-10-7-16-26(23)17-20-9-6-5-8-19(20)2/h5-14,16H,3-4,15,17-18H2,1-2H3,(H,25,29)