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

Systemtic Name: 1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]-3-phenethyl-urea Openeye Name: 1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]-3-phenethyl-urea CAS Name: 1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]-2-pyrimidinyl]-3-phenethylurea IUPAC Name: 1-[4-[3-(3-bromophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]-3-phenethylurea Traditional Name: 1-[4-[3-(3-bromophenyl)anthranil-5-yl]pyrimidin-2-yl]-3-phenethyl-urea Formula: C26H20BrN5O2 MolecularWeight: 514.3733

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H20BrN5O2/c27-20-8-4-7-19(15-20)24-21-16-18(9-10-23(21)32-34-24)22-12-14-28-25(30-22)31-26(33)29-13-11-17-5-2-1-3-6-17/h1-10,12,14-16H,11,13H2,(H2,28,29,30,31,33)