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

Systemtic Name: 1-heptyl-1-[2-[[4-(2-methylpropyl)phenyl]methyl]phenyl]urea Openeye Name: 1-heptyl-1-[2-[(4-isobutylphenyl)methyl]phenyl]urea CAS Name: 1-heptyl-1-[2-[[4-(2-methylpropyl)phenyl]methyl]phenyl]urea IUPAC Name: 1-heptyl-1-[2-[[4-(2-methylpropyl)phenyl]methyl]phenyl]urea Traditional Name: 1-heptyl-1-[2-(4-isobutylbenzyl)phenyl]urea Formula: C25H36N2O MolecularWeight: 380.56614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(C1=CC=CC=C1CC2=CC=C(C=C2)CC(C)C)C(=O)N

Isomeric SMILES

CCCCCCCN(C1=CC=CC=C1CC2=CC=C(C=C2)CC(C)C)C(=O)N

InChI

InChI=1S/C25H36N2O/c1-4-5-6-7-10-17-27(25(26)28)24-12-9-8-11-23(24)19-22-15-13-21(14-16-22)18-20(2)3/h8-9,11-16,20H,4-7,10,17-19H2,1-3H3,(H2,26,28)