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

Systemtic Name: N-(3-cyanophenyl)-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide Openeye Name: N-(3-cyanophenyl)-4-(5-cyano-2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(3-cyanophenyl)-4-(5-cyano-2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-cyanophenyl)-4-(5-cyanopyridin-2-yl)piperazine-1-carbothioamide Traditional Name: N-(3-cyanophenyl)-4-(5-cyano-2-pyridyl)piperazine-1-carbothioamide Formula: C18H16N6S MolecularWeight: 348.42484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N6S/c19-11-14-2-1-3-16(10-14)22-18(25)24-8-6-23(7-9-24)17-5-4-15(12-20)13-21-17/h1-5,10,13H,6-9H2,(H,22,25)