3-(3-chloranyl-4-fluoranyl-phenyl)-1-(2-cyanoethyl)-1-(furan-2-ylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-(2-cyanoethyl)-1-(furan-2-ylmethyl)thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-(2-cyanoethyl)-1-(2-furylmethyl)thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-(2-cyanoethyl)-1-(2-furanylmethyl)thiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-(2-cyanoethyl)-1-(furan-2-ylmethyl)thiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-(2-cyanoethyl)-1-(2-furfuryl)thiourea Formula: C15H13ClFN3OS MolecularWeight: 337.799623

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CCC#N)C(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

C1=COC(=C1)CN(CCC#N)C(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C15H13ClFN3OS/c16-13-9-11(4-5-14(13)17)19-15(22)20(7-2-6-18)10-12-3-1-8-21-12/h1,3-5,8-9H,2,7,10H2,(H,19,22)