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

Systemtic Name: N-(2-methylpyridin-4-yl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(2-methyl-4-pyridyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(2-methyl-4-pyridinyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(2-methylpyridin-4-yl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(2-methyl-4-pyridyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]coumarilamide Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC=NN4

Isomeric SMILES

CC1=NC=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC=NN4

InChI

InChI=1S/C18H15N5O2S/c1-11-8-12(6-7-19-11)22-17(24)16-14(9-26-18-20-10-21-23-18)13-4-2-3-5-15(13)25-16/h2-8,10H,9H2,1H3,(H,19,22,24)(H,20,21,23)