4-(4-fluorophenyl)carbonyl-N-(2-methylpropyl)piperidine-1-carbothioamide

Systemtic Name: 4-(4-fluorophenyl)carbonyl-N-(2-methylpropyl)piperidine-1-carbothioamide Openeye Name: 4-(4-fluorobenzoyl)-N-isobutyl-piperidine-1-carbothioamide CAS Name: 4-[(4-fluorophenyl)-oxomethyl]-N-(2-methylpropyl)-1-piperidinecarbothioamide IUPAC Name: 4-(4-fluorobenzoyl)-N-(2-methylpropyl)piperidine-1-carbothioamide Traditional Name: 4-(4-fluorobenzoyl)-N-isobutyl-piperidine-1-carbothioamide Formula: C17H23FN2OS MolecularWeight: 322.440723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)N1CCC(CC1)C(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)CNC(=S)N1CCC(CC1)C(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H23FN2OS/c1-12(2)11-19-17(22)20-9-7-14(8-10-20)16(21)13-3-5-15(18)6-4-13/h3-6,12,14H,7-11H2,1-2H3,(H,19,22)