(2-azanyl-2-oxidanylidene-ethyl) N-(4-sulfamoylphenyl)carbamodithioate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) N-(4-sulfamoylphenyl)carbamodithioate Openeye Name: (2-amino-2-oxo-ethyl) N-(4-sulfamoylphenyl)carbamodithioate CAS Name: N-(4-sulfamoylphenyl)carbamodithioic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) N-(4-sulfamoylphenyl)carbamodithioate Traditional Name: N-(4-sulfamoylphenyl)carbamodithioic acid (2-amino-2-keto-ethyl) ester Formula: C9H11N3O3S3 MolecularWeight: 305.39694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)SCC(=O)N)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=S)SCC(=O)N)S(=O)(=O)N

InChI

InChI=1S/C9H11N3O3S3/c10-8(13)5-17-9(16)12-6-1-3-7(4-2-6)18(11,14)15/h1-4H,5H2,(H2,10,13)(H,12,16)(H2,11,14,15)