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

Systemtic Name: 4-(5-cyanopyridin-2-yl)-N-phenethyl-piperazine-1-carbothioamide Openeye Name: 4-(5-cyano-2-pyridyl)-N-phenethyl-piperazine-1-carbothioamide CAS Name: 4-(5-cyano-2-pyridinyl)-N-phenethyl-1-piperazinecarbothioamide IUPAC Name: 4-(5-cyanopyridin-2-yl)-N-phenethylpiperazine-1-carbothioamide Traditional Name: 4-(5-cyano-2-pyridyl)-N-phenethyl-piperazine-1-carbothioamide Formula: C19H21N5S MolecularWeight: 351.46854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5S/c20-14-17-6-7-18(22-15-17)23-10-12-24(13-11-23)19(25)21-9-8-16-4-2-1-3-5-16/h1-7,15H,8-13H2,(H,21,25)