3-(4-chloranyl-2-methyl-phenyl)-1-heptyl-1-[[4-(2-methylpropyl)phenyl]methyl]urea

Systemtic Name: 3-(4-chloranyl-2-methyl-phenyl)-1-heptyl-1-[[4-(2-methylpropyl)phenyl]methyl]urea Openeye Name: 3-(4-chloro-2-methyl-phenyl)-1-heptyl-1-[(4-isobutylphenyl)methyl]urea CAS Name: 3-(4-chloro-2-methylphenyl)-1-heptyl-1-[[4-(2-methylpropyl)phenyl]methyl]urea IUPAC Name: 3-(4-chloro-2-methylphenyl)-1-heptyl-1-[[4-(2-methylpropyl)phenyl]methyl]urea Traditional Name: 3-(4-chloro-2-methyl-phenyl)-1-heptyl-1-(4-isobutylbenzyl)urea Formula: C26H37ClN2O MolecularWeight: 429.03778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CC1=CC=C(C=C1)CC(C)C)C(=O)NC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCCCCCCN(CC1=CC=C(C=C1)CC(C)C)C(=O)NC2=C(C=C(C=C2)Cl)C

InChI

InChI=1S/C26H37ClN2O/c1-5-6-7-8-9-16-29(19-23-12-10-22(11-13-23)17-20(2)3)26(30)28-25-15-14-24(27)18-21(25)4/h10-15,18,20H,5-9,16-17,19H2,1-4H3,(H,28,30)