[5-bromanyl-2-[3-(1-chloroethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone

Systemtic Name: [5-bromanyl-2-[3-(1-chloroethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-yl-methanone Openeye Name: [5-bromo-2-[3-(1-chloroethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone CAS Name: [5-bromo-2-[3-(1-chloroethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridinyl)methanone IUPAC Name: [5-bromo-2-[3-(1-chloroethyl)-1,2,4-triazol-4-yl]phenyl]-pyridin-2-ylmethanone Traditional Name: [5-bromo-2-[3-(1-chloroethyl)-1,2,4-triazol-4-yl]phenyl]-(2-pyridyl)methanone Formula: C16H12BrClN4O MolecularWeight: 391.64968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=CN1C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=N3)Cl

Isomeric SMILES

CC(C1=NN=CN1C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=N3)Cl

InChI

InChI=1S/C16H12BrClN4O/c1-10(18)16-21-20-9-22(16)14-6-5-11(17)8-12(14)15(23)13-4-2-3-7-19-13/h2-10H,1H3