N-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazepan-5-yl)ethanamide

Systemtic Name: N-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazepan-5-yl)ethanamide Openeye Name: N-(4-oxo-3-phenyl-2-thioxo-1,3-thiazepan-5-yl)acetamide CAS Name: N-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazepan-5-yl)acetamide IUPAC Name: N-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazepan-5-yl)acetamide Traditional Name: N-(4-keto-3-phenyl-2-thioxo-1,3-thiazepan-5-yl)acetamide Formula: C13H14N2O2S2 MolecularWeight: 294.39246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCSC(=S)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1CCSC(=S)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S2/c1-9(16)14-11-7-8-19-13(18)15(12(11)17)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,14,16)