N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-thioxo-1H-pyridine-3-carboxamide CAS Name: N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-2-sulfanylidene-1H-pyridine-3-carboxamide IUPAC Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-pyridine-3-carboxamide Traditional Name: N-[3-[4-(2-pyrimidyl)piperazino]propyl]-2-thioxo-1H-pyridine-3-carboxamide Formula: C17H22N6OS MolecularWeight: 358.46118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC=CNC2=S)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC=CNC2=S)C3=NC=CC=N3

InChI

InChI=1S/C17H22N6OS/c24-15(14-4-1-5-19-16(14)25)18-8-3-9-22-10-12-23(13-11-22)17-20-6-2-7-21-17/h1-2,4-7H,3,8-13H2,(H,18,24)(H,19,25)