N-[(1-ethylpyrazol-4-yl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-[(1-ethylpyrazol-4-yl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-[(1-ethylpyrazol-4-yl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-[(1-ethyl-4-pyrazolyl)methyl]-4-[(4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[(1-ethylpyrazol-4-yl)methyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-[(1-ethylpyrazol-4-yl)methyl]-4-(4-fluorobenzyl)piperazine-1-carbothioamide Formula: C18H24FN5S MolecularWeight: 361.480063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC(=S)N2CCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCN1C=C(C=N1)CNC(=S)N2CCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H24FN5S/c1-2-24-14-16(12-21-24)11-20-18(25)23-9-7-22(8-10-23)13-15-3-5-17(19)6-4-15/h3-6,12,14H,2,7-11,13H2,1H3,(H,20,25)