N-(4-ethoxyphenyl)-4-[(3-fluorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[(3-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(4-ethoxyphenyl)-4-[(3-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(4-ethoxyphenyl)-4-[(3-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-ethoxyphenyl)-4-[(3-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(3-fluorobenzyl)-N-p-phenetyl-piperazine-1-carbothioamide Formula: C20H24FN3OS MolecularWeight: 373.487463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H24FN3OS/c1-2-25-19-8-6-18(7-9-19)22-20(26)24-12-10-23(11-13-24)15-16-4-3-5-17(21)14-16/h3-9,14H,2,10-13,15H2,1H3,(H,22,26)