(4-pyrimidin-2-ylpiperazin-1-yl)-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C14H15N5OS/c20-13(11-3-1-4-15-12(11)21)18-7-9-19(10-8-18)14-16-5-2-6-17-14/h1-6H,7-10H2,(H,15,21)