N-[2-(4-chlorophenyl)ethyl]-4-(oxolan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-(oxolan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-[oxo(2-oxolanyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-(oxolane-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioamide Formula: C18H24ClN3O2S MolecularWeight: 381.92006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CCN(CC2)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC(OC1)C(=O)N2CCN(CC2)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H24ClN3O2S/c19-15-5-3-14(4-6-15)7-8-20-18(25)22-11-9-21(10-12-22)17(23)16-2-1-13-24-16/h3-6,16H,1-2,7-13H2,(H,20,25)