4-[(4-ethoxyphenyl)amino]-N-[(4-fluorophenyl)methyl]piperidine-1-carbothioamide

Systemtic Name: 4-[(4-ethoxyphenyl)amino]-N-[(4-fluorophenyl)methyl]piperidine-1-carbothioamide Openeye Name: 4-(4-ethoxyanilino)-N-[(4-fluorophenyl)methyl]piperidine-1-carbothioamide CAS Name: 4-(4-ethoxyanilino)-N-[(4-fluorophenyl)methyl]-1-piperidinecarbothioamide IUPAC Name: 4-(4-ethoxyanilino)-N-[(4-fluorophenyl)methyl]piperidine-1-carbothioamide Traditional Name: N-(4-fluorobenzyl)-4-(p-phenetidino)piperidine-1-carbothioamide Formula: C21H26FN3OS MolecularWeight: 387.514043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2CCN(CC2)C(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2CCN(CC2)C(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3OS/c1-2-26-20-9-7-18(8-10-20)24-19-11-13-25(14-12-19)21(27)23-15-16-3-5-17(22)6-4-16/h3-10,19,24H,2,11-15H2,1H3,(H,23,27)