N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[4-(3-oxo-1-piperazinyl)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[4-(3-oxopiperazin-1-yl)phenyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N4O2S/c21-14-10-20(9-8-17-14)12-5-3-11(4-6-12)19-15(22)13-2-1-7-18-16(13)23/h1-7H,8-10H2,(H,17,21)(H,18,23)(H,19,22)