1-butyl-3,3-bis[3-(chloromethyl)phenyl]-1-(phenylmethyl)urea

Systemtic Name: 1-butyl-3,3-bis[3-(chloromethyl)phenyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-butyl-3,3-bis[3-(chloromethyl)phenyl]urea CAS Name: 1-butyl-3,3-bis[3-(chloromethyl)phenyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-butyl-3,3-bis[3-(chloromethyl)phenyl]urea Traditional Name: 1-benzyl-1-butyl-3,3-bis[3-(chloromethyl)phenyl]urea Formula: C26H28Cl2N2O MolecularWeight: 455.41932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=O)N(C2=CC=CC(=C2)CCl)C3=CC=CC(=C3)CCl

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=O)N(C2=CC=CC(=C2)CCl)C3=CC=CC(=C3)CCl

InChI

InChI=1S/C26H28Cl2N2O/c1-2-3-15-29(20-21-9-5-4-6-10-21)26(31)30(24-13-7-11-22(16-24)18-27)25-14-8-12-23(17-25)19-28/h4-14,16-17H,2-3,15,18-20H2,1H3