3-(2-methylphenyl)-1-(phenylmethyl)-1-tridecyl-urea

Systemtic Name: 3-(2-methylphenyl)-1-(phenylmethyl)-1-tridecyl-urea Openeye Name: 1-benzyl-3-(o-tolyl)-1-tridecyl-urea CAS Name: 3-(2-methylphenyl)-1-(phenylmethyl)-1-tridecylurea IUPAC Name: 1-benzyl-3-(2-methylphenyl)-1-tridecylurea Traditional Name: 1-benzyl-3-(o-tolyl)-1-tridecyl-urea Formula: C28H42N2O MolecularWeight: 422.64588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCN(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCCCCCN(CC1=CC=CC=C1)C(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C28H42N2O/c1-3-4-5-6-7-8-9-10-11-12-18-23-30(24-26-20-14-13-15-21-26)28(31)29-27-22-17-16-19-25(27)2/h13-17,19-22H,3-12,18,23-24H2,1-2H3,(H,29,31)