1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]urea CAS Name: 1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]-2-pyrimidinyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]urea Traditional Name: 1-benzyl-3-[4-[3-(3-bromophenyl)anthranil-5-yl]pyrimidin-2-yl]urea Formula: C25H18BrN5O2 MolecularWeight: 500.34672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC2=NC=CC(=N2)C3=CC4=C(ON=C4C=C3)C5=CC(=CC=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NC2=NC=CC(=N2)C3=CC4=C(ON=C4C=C3)C5=CC(=CC=C5)Br

InChI

InChI=1S/C25H18BrN5O2/c26-19-8-4-7-18(13-19)23-20-14-17(9-10-22(20)31-33-23)21-11-12-27-24(29-21)30-25(32)28-15-16-5-2-1-3-6-16/h1-14H,15H2,(H2,27,28,29,30,32)