N-[2-(4-chlorophenyl)sulfanylethyl]-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(furan-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-[2-furanyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(furan-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-(2-furoyl)piperazine-1-carbothioamide Formula: C18H20ClN3O2S2 MolecularWeight: 409.9533

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CO2)C(=S)NCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CO2)C(=S)NCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN3O2S2/c19-14-3-5-15(6-4-14)26-13-7-20-18(25)22-10-8-21(9-11-22)17(23)16-2-1-12-24-16/h1-6,12H,7-11,13H2,(H,20,25)