2-(benzotriazol-1-yl)-N-[3-(4-bromanylpyrazol-1-yl)propyl]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[3-(4-bromanylpyrazol-1-yl)propyl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[3-(4-bromopyrazol-1-yl)propyl]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[3-(4-bromo-1-pyrazolyl)propyl]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[3-(4-bromopyrazol-1-yl)propyl]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[3-(4-bromopyrazol-1-yl)propyl]acetamide Formula: C14H15BrN6O MolecularWeight: 363.2125

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC(=O)NCCCN3C=C(C=N3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC(=O)NCCCN3C=C(C=N3)Br

InChI

InChI=1S/C14H15BrN6O/c15-11-8-17-20(9-11)7-3-6-16-14(22)10-21-13-5-2-1-4-12(13)18-19-21/h1-2,4-5,8-9H,3,6-7,10H2,(H,16,22)