N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=CC=CNC3=S

InChI

InChI=1S/C15H15N5O2S/c21-13-9-20(7-6-16-13)12-4-3-10(8-18-12)19-14(22)11-2-1-5-17-15(11)23/h1-5,8H,6-7,9H2,(H,16,21)(H,17,23)(H,19,22)