N-(4-methyl-3-nitro-phenyl)-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-3-(methylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(4-methyl-3-nitrophenyl)-3-[(methylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-3-[(methylthio)methyl]coumarilamide Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O4S/c1-11-7-8-12(9-15(11)20(22)23)19-18(21)17-14(10-25-2)13-5-3-4-6-16(13)24-17/h3-9H,10H2,1-2H3,(H,19,21)