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

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-2H-benzotriazole-5-carboxamide Formula: C16H15FN4OS MolecularWeight: 330.379903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC3=NNN=C3C=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC3=NNN=C3C=C2)F

InChI

InChI=1S/C16H15FN4OS/c17-13-4-2-1-3-12(13)10-23-8-7-18-16(22)11-5-6-14-15(9-11)20-21-19-14/h1-6,9H,7-8,10H2,(H,18,22)(H,19,20,21)