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

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-[(4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-(4-fluorobenzyl)piperazine-1-carbothioamide Formula: C17H27FN4S MolecularWeight: 338.486483

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)N1CCN(CC1)CC2=CC=C(C=C2)F

Isomeric SMILES

CN(C)CCCNC(=S)N1CCN(CC1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C17H27FN4S/c1-20(2)9-3-8-19-17(23)22-12-10-21(11-13-22)14-15-4-6-16(18)7-5-15/h4-7H,3,8-14H2,1-2H3,(H,19,23)