N-(2-methoxy-5-nitro-phenyl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-(benzylthio)-N-(2-methoxy-5-nitro-phenyl)acetamide Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C16H16N2O4S/c1-22-15-8-7-13(18(20)21)9-14(15)17-16(19)11-23-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,17,19)