N-(2,6-diethylphenyl)-4-(2-fluorophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2,6-diethylphenyl)-4-(2-fluorophenyl)piperazine-1-carbothioamide Openeye Name: N-(2,6-diethylphenyl)-4-(2-fluorophenyl)piperazine-1-carbothioamide CAS Name: N-(2,6-diethylphenyl)-4-(2-fluorophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(2,6-diethylphenyl)-4-(2-fluorophenyl)piperazine-1-carbothioamide Traditional Name: N-(2,6-diethylphenyl)-4-(2-fluorophenyl)piperazine-1-carbothioamide Formula: C21H26FN3S MolecularWeight: 371.514643

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C21H26FN3S/c1-3-16-8-7-9-17(4-2)20(16)23-21(26)25-14-12-24(13-15-25)19-11-6-5-10-18(19)22/h5-11H,3-4,12-15H2,1-2H3,(H,23,26)