2-fluoranyl-5-[3-oxidanylidene-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-1-ynyl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-5-[3-oxidanylidene-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-1-ynyl]benzenecarbonitrile Openeye Name: 2-fluoro-5-[3-oxo-3-(4-thiazol-2-ylpiperazin-1-yl)prop-1-ynyl]benzonitrile CAS Name: 2-fluoro-5-[3-oxo-3-[4-(2-thiazolyl)-1-piperazinyl]prop-1-ynyl]benzonitrile IUPAC Name: 2-fluoro-5-[3-oxo-3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]prop-1-ynyl]benzonitrile Traditional Name: 2-fluoro-5-[3-keto-3-(4-thiazol-2-ylpiperazino)prop-1-ynyl]benzonitrile Formula: C17H13FN4OS MolecularWeight: 340.374723

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CS2)C(=O)C#CC3=CC(=C(C=C3)F)C#N

Isomeric SMILES

C1CN(CCN1C2=NC=CS2)C(=O)C#CC3=CC(=C(C=C3)F)C#N

InChI

InChI=1S/C17H13FN4OS/c18-15-3-1-13(11-14(15)12-19)2-4-16(23)21-6-8-22(9-7-21)17-20-5-10-24-17/h1,3,5,10-11H,6-9H2