N-[2-(4-chlorophenyl)ethyl]-4-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C20H24ClN3OS MolecularWeight: 389.94206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3OS/c1-25-19-4-2-3-18(15-19)23-11-13-24(14-12-23)20(26)22-10-9-16-5-7-17(21)8-6-16/h2-8,15H,9-14H2,1H3,(H,22,26)