N-[3-(4-methoxyphenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazepan-5-yl]ethanamide

Systemtic Name: N-[3-(4-methoxyphenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazepan-5-yl]ethanamide Openeye Name: N-[3-(4-methoxyphenyl)-4-oxo-2-thioxo-1,3-thiazepan-5-yl]acetamide CAS Name: N-[3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazepan-5-yl]acetamide IUPAC Name: N-[3-(4-methoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazepan-5-yl]acetamide Traditional Name: N-[4-keto-3-(4-methoxyphenyl)-2-thioxo-1,3-thiazepan-5-yl]acetamide Formula: C14H16N2O3S2 MolecularWeight: 324.41844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3S2/c1-9(17)15-12-7-8-21-14(20)16(13(12)18)10-3-5-11(19-2)6-4-10/h3-6,12H,7-8H2,1-2H3,(H,15,17)