2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSCC1=CC(=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)NC(=O)CSCC1=CC(=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O4S/c1-5-15(2,3)16-14(18)10-22-9-11-6-7-13(21-4)12(8-11)17(19)20/h6-8H,5,9-10H2,1-4H3,(H,16,18)