N-(3-chloranyl-4-fluoranyl-phenyl)-1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3-chloro-4-fluorophenyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-1-keto-4-phenyl-2,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C20H20ClFN4OS MolecularWeight: 418.915403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)C(=S)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)C(=S)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C20H20ClFN4OS/c21-16-12-14(6-7-17(16)22)24-19(28)25-10-8-20(9-11-25)18(27)23-13-26(20)15-4-2-1-3-5-15/h1-7,12H,8-11,13H2,(H,23,27)(H,24,28)