4-[[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoylamino]methyl]-N,N-dimethyl-benzamide

Systemtic Name: 4-[[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoylamino]methyl]-N,N-dimethyl-benzamide Openeye Name: 4-[[[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetyl]amino]methyl]-N,N-dimethyl-benzamide CAS Name: 4-[[[2-[(4-methoxy-3-nitrophenyl)methylthio]-1-oxoethyl]amino]methyl]-N,N-dimethylbenzamide IUPAC Name: 4-[[[2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetyl]amino]methyl]-N,N-dimethylbenzamide Traditional Name: 4-[[[2-[(4-methoxy-3-nitro-benzyl)thio]acetyl]amino]methyl]-N,N-dimethyl-benzamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)CNC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-22(2)20(25)16-7-4-14(5-8-16)11-21-19(24)13-29-12-15-6-9-18(28-3)17(10-15)23(26)27/h4-10H,11-13H2,1-3H3,(H,21,24)