N-(3-chlorophenyl)-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-4-(5-cyano-2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(3-chlorophenyl)-4-(5-cyano-2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-chlorophenyl)-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-4-(5-cyano-2-pyridyl)piperazine-1-carbothioamide Formula: C17H16ClN5S MolecularWeight: 357.86044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H16ClN5S/c18-14-2-1-3-15(10-14)21-17(24)23-8-6-22(7-9-23)16-5-4-13(11-19)12-20-16/h1-5,10,12H,6-9H2,(H,21,24)