methyl (NZ)-N-[methylsulfanyl-[(2-nitro-5-propylsulfinyl-phenyl)amino]methylidene]carbamate

Systemtic Name: methyl (NZ)-N-[methylsulfanyl-[(2-nitro-5-propylsulfinyl-phenyl)amino]methylidene]carbamate Openeye Name: methyl (NZ)-N-[methylsulfanyl-(2-nitro-5-propylsulfinyl-anilino)methylene]carbamate CAS Name: (NZ)-N-[(methylthio)-(2-nitro-5-propylsulfinylanilino)methylidene]carbamic acid methyl ester IUPAC Name: methyl (NZ)-N-[methylsulfanyl-(2-nitro-5-propylsulfinylanilino)methylidene]carbamate Traditional Name: (NZ)-N-[(methylthio)-(2-nitro-5-propylsulfinyl-anilino)methylene]carbamic acid methyl ester Formula: C13H17N3O5S2 MolecularWeight: 359.42118

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)C1=CC(=C(C=C1)[N+](=O)[O-])NC(=NC(=O)OC)SC

Isomeric SMILES

CCCS(=O)C1=CC(=C(C=C1)[N+](=O)[O-])N/C(=N/C(=O)OC)/SC

InChI

InChI=1S/C13H17N3O5S2/c1-4-7-23(20)9-5-6-11(16(18)19)10(8-9)14-12(22-3)15-13(17)21-2/h5-6,8H,4,7H2,1-3H3,(H,14,15,17)