6-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide

Systemtic Name: 6-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide Openeye Name: 6-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide CAS Name: 6-(4-phenyl-1-piperazinyl)-3-pyridinecarbothioamide IUPAC Name: 6-(4-phenylpiperazin-1-yl)pyridine-3-carbothioamide Traditional Name: 6-(4-phenylpiperazino)thionicotinamide Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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