N-[2-(4-chlorophenyl)ethyl]-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-(5-cyano-2-pyridyl)piperazine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-(5-cyano-2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-4-(5-cyano-2-pyridyl)piperazine-1-carbothioamide Formula: C19H20ClN5S MolecularWeight: 385.9136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN5S/c20-17-4-1-15(2-5-17)7-8-22-19(26)25-11-9-24(10-12-25)18-6-3-16(13-21)14-23-18/h1-6,14H,7-12H2,(H,22,26)