N-[2-(4-chlorophenyl)sulfanylethyl]-4-(thiophen-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(thiophen-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(2-thienylmethyl)piperazine-1-carbothioamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-(thiophen-2-ylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(thiophen-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-(2-thenyl)piperazine-1-carbothioamide Formula: C18H22ClN3S3 MolecularWeight: 412.03538

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)C(=S)NCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)C(=S)NCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H22ClN3S3/c19-15-3-5-16(6-4-15)25-13-7-20-18(23)22-10-8-21(9-11-22)14-17-2-1-12-24-17/h1-6,12H,7-11,13-14H2,(H,20,23)