4-(4-cyanophenyl)-N-(pyridin-3-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-cyanophenyl)-N-(pyridin-3-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(4-cyanophenyl)-N-(3-pyridylmethyl)piperazine-1-carbothioamide CAS Name: 4-(4-cyanophenyl)-N-(3-pyridinylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-cyanophenyl)-N-(pyridin-3-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(4-cyanophenyl)-N-(3-pyridylmethyl)piperazine-1-carbothioamide Formula: C18H19N5S MolecularWeight: 337.44196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=S)NCC3=CN=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C#N)C(=S)NCC3=CN=CC=C3

InChI

InChI=1S/C18H19N5S/c19-12-15-3-5-17(6-4-15)22-8-10-23(11-9-22)18(24)21-14-16-2-1-7-20-13-16/h1-7,13H,8-11,14H2,(H,21,24)