N-[4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]furan-2-carboxamide

Systemtic Name: N-[4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]furan-2-carboxamide Openeye Name: N-[4-[2-(2-methyl-5-nitro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]furan-2-carboxamide CAS Name: N-[4-[[2-(2-methyl-5-nitroanilino)-2-oxo-1-phenylethyl]thio]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[2-(2-methyl-5-nitroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]furan-2-carboxamide Traditional Name: N-[4-[[2-keto-2-(2-methyl-5-nitro-anilino)-1-phenyl-ethyl]thio]phenyl]-2-furamide Formula: C26H21N3O5S MolecularWeight: 487.52704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C26H21N3O5S/c1-17-9-12-20(29(32)33)16-22(17)28-26(31)24(18-6-3-2-4-7-18)35-21-13-10-19(11-14-21)27-25(30)23-8-5-15-34-23/h2-16,24H,1H3,(H,27,30)(H,28,31)