N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-2H-benzotriazole-5-carboxamide Formula: C17H18FN5O MolecularWeight: 327.356123

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC2=NNN=C2C=C1)C3=CC(=CC=C3)F

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC2=NNN=C2C=C1)C3=CC(=CC=C3)F

InChI

InChI=1S/C17H18FN5O/c1-23(2)16(11-4-3-5-13(18)8-11)10-19-17(24)12-6-7-14-15(9-12)21-22-20-14/h3-9,16H,10H2,1-2H3,(H,19,24)(H,20,21,22)