1-[4-(1-adamantyl)-2-bromanyl-phenyl]-3-(3-chlorophenyl)urea

Systemtic Name: 1-[4-(1-adamantyl)-2-bromanyl-phenyl]-3-(3-chlorophenyl)urea Openeye Name: 1-[4-(1-adamantyl)-2-bromo-phenyl]-3-(3-chlorophenyl)urea CAS Name: 1-[4-(1-adamantyl)-2-bromophenyl]-3-(3-chlorophenyl)urea IUPAC Name: 1-[4-(1-adamantyl)-2-bromophenyl]-3-(3-chlorophenyl)urea Traditional Name: 1-[4-(1-adamantyl)-2-bromo-phenyl]-3-(3-chlorophenyl)urea Formula: C23H24BrClN2O MolecularWeight: 459.80646

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)NC(=O)NC5=CC(=CC=C5)Cl)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC(=C(C=C4)NC(=O)NC5=CC(=CC=C5)Cl)Br

InChI

InChI=1S/C23H24BrClN2O/c24-20-9-17(23-11-14-6-15(12-23)8-16(7-14)13-23)4-5-21(20)27-22(28)26-19-3-1-2-18(25)10-19/h1-5,9-10,14-16H,6-8,11-13H2,(H2,26,27,28)