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

Systemtic Name: 4-(5-cyanopyridin-2-yl)-N-(2-phenylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(5-cyano-2-pyridyl)-N-(2-phenylphenyl)piperazine-1-carbothioamide CAS Name: 4-(5-cyano-2-pyridinyl)-N-(2-phenylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(5-cyanopyridin-2-yl)-N-(2-phenylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(5-cyano-2-pyridyl)-N-(2-phenylphenyl)piperazine-1-carbothioamide Formula: C23H21N5S MolecularWeight: 399.51134

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=S)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C#N)C(=S)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C23H21N5S/c24-16-18-10-11-22(25-17-18)27-12-14-28(15-13-27)23(29)26-21-9-5-4-8-20(21)19-6-2-1-3-7-19/h1-11,17H,12-15H2,(H,26,29)