N-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(4-fluorophenyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(4-fluorophenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(4-fluorophenyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]coumarilamide Formula: C18H13FN4O2S MolecularWeight: 368.384823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C(=O)NC3=CC=C(C=C3)F)CSC4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C(=O)NC3=CC=C(C=C3)F)CSC4=NC=NN4

InChI

InChI=1S/C18H13FN4O2S/c19-11-5-7-12(8-6-11)22-17(24)16-14(9-26-18-20-10-21-23-18)13-3-1-2-4-15(13)25-16/h1-8,10H,9H2,(H,22,24)(H,20,21,23)