N-[1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-3-fluoranyl-benzamide Openeye Name: N-[1-[(2-ethylphenyl)carbamothioyl]-4-piperidyl]-3-fluoro-benzamide CAS Name: N-[1-[(2-ethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-3-fluorobenzamide IUPAC Name: N-[1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-3-fluorobenzamide Traditional Name: N-[1-[(2-ethylphenyl)thiocarbamoyl]-4-piperidyl]-3-fluoro-benzamide Formula: C21H24FN3OS MolecularWeight: 385.498163

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCC(CC2)NC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCC(CC2)NC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN3OS/c1-2-15-6-3-4-9-19(15)24-21(27)25-12-10-18(11-13-25)23-20(26)16-7-5-8-17(22)14-16/h3-9,14,18H,2,10-13H2,1H3,(H,23,26)(H,24,27)