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

Systemtic Name: N-[1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[(2-ethylphenyl)carbamothioyl]-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-[(2-ethylanilino)-sulfanylidenemethyl]-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-[(2-ethylphenyl)carbamothioyl]piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[(2-ethylphenyl)thiocarbamoyl]-4-piperidyl]-4-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=C(C=C3)F

Isomeric SMILES

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

InChI

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