(2-nitro-4-sulfamoyl-phenyl) N,N-diethylcarbamodithioate

Systemtic Name: (2-nitro-4-sulfamoyl-phenyl) N,N-diethylcarbamodithioate Openeye Name: (2-nitro-4-sulfamoyl-phenyl) N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid (2-nitro-4-sulfamoylphenyl) ester IUPAC Name: (2-nitro-4-sulfamoylphenyl) N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (2-nitro-4-sulfamoyl-phenyl) ester Formula: C11H15N3O4S3 MolecularWeight: 349.4495

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=S)SC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O4S3/c1-3-13(4-2)11(19)20-10-6-5-8(21(12,17)18)7-9(10)14(15)16/h5-7H,3-4H2,1-2H3,(H2,12,17,18)