N-(4-isothiocyanatophenyl)sulfonylethanamide

Systemtic Name: N-(4-isothiocyanatophenyl)sulfonylethanamide Openeye Name: N-(4-isothiocyanatophenyl)sulfonylacetamide CAS Name: N-(4-isothiocyanatophenyl)sulfonylacetamide IUPAC Name: N-(4-isothiocyanatophenyl)sulfonylacetamide Traditional Name: N-(4-isothiocyanatophenyl)sulfonylacetamide Formula: C9H8N2O3S2 MolecularWeight: 256.30142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N=C=S

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N=C=S

InChI

InChI=1S/C9H8N2O3S2/c1-7(12)11-16(13,14)9-4-2-8(3-5-9)10-6-15/h2-5H,1H3,(H,11,12)