4-butyl-N-(2-fluorophenyl)-3-oxidanylidene-2-propan-2-yl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: 4-butyl-N-(2-fluorophenyl)-3-oxidanylidene-2-propan-2-yl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Openeye Name: 4-butyl-N-(2-fluorophenyl)-2-isopropyl-3-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide CAS Name: 4-butyl-N-(2-fluorophenyl)-3-oxo-2-propan-2-yl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide IUPAC Name: 4-butyl-N-(2-fluorophenyl)-3-oxo-2-propan-2-yl-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Traditional Name: 4-butyl-N-(2-fluorophenyl)-2-isopropyl-3-keto-1,4,8-triazaspiro[4.5]decane-8-carbothioamide Formula: C21H31FN4OS MolecularWeight: 406.560443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(NC12CCN(CC2)C(=S)NC3=CC=CC=C3F)C(C)C

Isomeric SMILES

CCCCN1C(=O)C(NC12CCN(CC2)C(=S)NC3=CC=CC=C3F)C(C)C

InChI

InChI=1S/C21H31FN4OS/c1-4-5-12-26-19(27)18(15(2)3)24-21(26)10-13-25(14-11-21)20(28)23-17-9-7-6-8-16(17)22/h6-9,15,18,24H,4-5,10-14H2,1-3H3,(H,23,28)