1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(3-chloranyl-4-fluoranyl-phenyl)-1-ethyl-thiourea

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-3-(3-chloranyl-4-fluoranyl-phenyl)-1-ethyl-thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-(1,1-dioxothiolan-3-yl)-1-ethyl-thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-(1,1-dioxo-3-thiolanyl)-1-ethylthiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-(1,1-dioxothiolan-3-yl)-1-ethylthiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-(1,1-diketothiolan-3-yl)-1-ethyl-thiourea Formula: C13H16ClFN2O2S2 MolecularWeight: 350.859743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCN(C1CCS(=O)(=O)C1)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C13H16ClFN2O2S2/c1-2-17(10-5-6-21(18,19)8-10)13(20)16-9-3-4-12(15)11(14)7-9/h3-4,7,10H,2,5-6,8H2,1H3,(H,16,20)