2-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide

Systemtic Name: 2-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide Openeye Name: 2-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide CAS Name: 2-(4-phenyl-1-piperazinyl)-3-pyridinecarbothioamide IUPAC Name: 2-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide Traditional Name: 2-(4-phenylpiperazino)thionicotinamide Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=CC=N3)C(=S)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=CC=N3)C(=S)N

InChI

InChI=1S/C16H18N4S/c17-15(21)14-7-4-8-18-16(14)20-11-9-19(10-12-20)13-5-2-1-3-6-13/h1-8H,9-12H2,(H2,17,21)