N-(3-fluorophenyl)-2-[4-(6-sulfanylideneheptanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(6-sulfanylideneheptanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-(6-thioxoheptanoyl)piperazin-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-(1-oxo-6-sulfanylideneheptyl)-1-piperazinyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(6-sulfanylideneheptanoyl)piperazin-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-(6-thioxoheptanoyl)piperazino]acetamide Formula: C19H26FN3O2S MolecularWeight: 379.492043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)CCCCC(=O)N1CCN(CC1)CC(=O)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(=S)CCCCC(=O)N1CCN(CC1)CC(=O)NC2=CC(=CC=C2)F

InChI

InChI=1S/C19H26FN3O2S/c1-15(26)5-2-3-8-19(25)23-11-9-22(10-12-23)14-18(24)21-17-7-4-6-16(20)13-17/h4,6-7,13H,2-3,5,8-12,14H2,1H3,(H,21,24)