N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-3-(4-chlorophenyl)prop-2-enamide

Systemtic Name: N-[2-(5-bromanylpyridin-3-yl)-1,3-benzoxazol-5-yl]-3-(4-chlorophenyl)prop-2-enamide Openeye Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-3-(4-chlorophenyl)prop-2-enamide CAS Name: N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]-3-(4-chlorophenyl)-2-propenamide IUPAC Name: N-[2-(5-bromopyridin-3-yl)-1,3-benzoxazol-5-yl]-3-(4-chlorophenyl)prop-2-enamide Traditional Name: N-[2-(5-bromo-3-pyridyl)-1,3-benzoxazol-5-yl]-3-(4-chlorophenyl)acrylamide Formula: C21H13BrClN3O2 MolecularWeight: 454.70382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CN=C4)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C=CC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=CN=C4)Br)Cl

InChI

InChI=1S/C21H13BrClN3O2/c22-15-9-14(11-24-12-15)21-26-18-10-17(6-7-19(18)28-21)25-20(27)8-3-13-1-4-16(23)5-2-13/h1-12H,(H,25,27)