N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-7-fluoranyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-7-fluoranyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-7-fluoro-3-methyl-benzofuran-2-carboxamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-7-fluoro-3-methyl-2-benzofurancarboxamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-7-fluoro-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-7-fluoro-3-methyl-coumarilamide Formula: C21H25FN4O2S MolecularWeight: 416.512203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC=C2F)C(=O)NCCCC3=NN=C(N3C4CCCC4)SC

Isomeric SMILES

CC1=C(OC2=C1C=CC=C2F)C(=O)NCCCC3=NN=C(N3C4CCCC4)SC

InChI

InChI=1S/C21H25FN4O2S/c1-13-15-9-5-10-16(22)19(15)28-18(13)20(27)23-12-6-11-17-24-25-21(29-2)26(17)14-7-3-4-8-14/h5,9-10,14H,3-4,6-8,11-12H2,1-2H3,(H,23,27)