1-[1-(4-bromophenyl)ethyl]-3-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]urea

Systemtic Name: 1-[1-(4-bromophenyl)ethyl]-3-[4-(2-phenylazanylpyridin-4-yl)pyridin-2-yl]urea Openeye Name: 1-[4-(2-anilino-4-pyridyl)-2-pyridyl]-3-[1-(4-bromophenyl)ethyl]urea CAS Name: 1-[4-(2-anilino-4-pyridinyl)-2-pyridinyl]-3-[1-(4-bromophenyl)ethyl]urea IUPAC Name: 1-[4-(2-anilinopyridin-4-yl)pyridin-2-yl]-3-[1-(4-bromophenyl)ethyl]urea Traditional Name: 1-[4-(2-anilino-4-pyridyl)-2-pyridyl]-3-[1-(4-bromophenyl)ethyl]urea Formula: C25H22BrN5O MolecularWeight: 488.37908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(=O)NC2=NC=CC(=C2)C3=CC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C25H22BrN5O/c1-17(18-7-9-21(26)10-8-18)29-25(32)31-24-16-20(12-14-28-24)19-11-13-27-23(15-19)30-22-5-3-2-4-6-22/h2-17H,1H3,(H,27,30)(H2,28,29,31,32)