(2S)-2-(furan-2-ylmethylsulfanyl)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(furan-2-ylmethylsulfanyl)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-(2-furylmethylsulfanyl)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide CAS Name: (2S)-2-(2-furanylmethylthio)-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide IUPAC Name: (2S)-2-(furan-2-ylmethylsulfanyl)-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide Traditional Name: (2S)-2-(2-furfurylthio)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)SCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O4S/c1-14-9-10-17(18(12-14)22(24)25)21-20(23)19(15-6-3-2-4-7-15)27-13-16-8-5-11-26-16/h2-12,19H,13H2,1H3,(H,21,23)/t19-/m0/s1