N-(4-ethoxyphenyl)-4-(4-fluorophenyl)carbonyl-piperidine-1-carbothioamide

Systemtic Name: N-(4-ethoxyphenyl)-4-(4-fluorophenyl)carbonyl-piperidine-1-carbothioamide Openeye Name: N-(4-ethoxyphenyl)-4-(4-fluorobenzoyl)piperidine-1-carbothioamide CAS Name: N-(4-ethoxyphenyl)-4-[(4-fluorophenyl)-oxomethyl]-1-piperidinecarbothioamide IUPAC Name: N-(4-ethoxyphenyl)-4-(4-fluorobenzoyl)piperidine-1-carbothioamide Traditional Name: 4-(4-fluorobenzoyl)-N-p-phenetyl-piperidine-1-carbothioamide Formula: C21H23FN2O2S MolecularWeight: 386.482923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCC(CC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN2O2S/c1-2-26-19-9-7-18(8-10-19)23-21(27)24-13-11-16(12-14-24)20(25)15-3-5-17(22)6-4-15/h3-10,16H,2,11-14H2,1H3,(H,23,27)