N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(3-chloranyl-4-fluoranyl-phenyl)sulfanyl-propanamide Openeye Name: 2-(3-chloro-4-fluoro-phenyl)sulfanyl-N-(1,1-dioxothiolan-3-yl)propanamide CAS Name: 2-[(3-chloro-4-fluorophenyl)thio]-N-(1,1-dioxo-3-thiolanyl)propanamide IUPAC Name: 2-(3-chloro-4-fluorophenyl)sulfanyl-N-(1,1-dioxothiolan-3-yl)propanamide Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)thio]-N-(1,1-diketothiolan-3-yl)propionamide Formula: C13H15ClFNO3S2 MolecularWeight: 351.844503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCS(=O)(=O)C1)SC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(C(=O)NC1CCS(=O)(=O)C1)SC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H15ClFNO3S2/c1-8(20-10-2-3-12(15)11(14)6-10)13(17)16-9-4-5-21(18,19)7-9/h2-3,6,8-9H,4-5,7H2,1H3,(H,16,17)