1-(1-adamantyl)-3-[2,6-bis(bromanyl)-3-chloranyl-4-methyl-phenyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[2,6-bis(bromanyl)-3-chloranyl-4-methyl-phenyl]urea Openeye Name: 1-(1-adamantyl)-3-(2,6-dibromo-3-chloro-4-methyl-phenyl)urea CAS Name: 1-(1-adamantyl)-3-(2,6-dibromo-3-chloro-4-methylphenyl)urea IUPAC Name: 1-(1-adamantyl)-3-(2,6-dibromo-3-chloro-4-methylphenyl)urea Traditional Name: 1-(1-adamantyl)-3-(2,6-dibromo-3-chloro-4-methyl-phenyl)urea Formula: C18H21Br2ClN2O MolecularWeight: 476.63314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)Br)NC(=O)NC23CC4CC(C2)CC(C4)C3)Br

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)Br)NC(=O)NC23CC4CC(C2)CC(C4)C3)Br

InChI

InChI=1S/C18H21Br2ClN2O/c1-9-2-13(19)16(14(20)15(9)21)22-17(24)23-18-6-10-3-11(7-18)5-12(4-10)8-18/h2,10-12H,3-8H2,1H3,(H2,22,23,24)