2-fluoranyl-N-[1-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]pyrazol-4-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[1-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]pyrazol-4-yl]benzamide Openeye Name: 2-fluoro-N-[1-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]pyrazol-4-yl]benzamide CAS Name: 2-fluoro-N-[1-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]-4-pyrazolyl]benzamide IUPAC Name: 2-fluoro-N-[1-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]pyrazol-4-yl]benzamide Traditional Name: 2-fluoro-N-[1-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]pyrazol-4-yl]benzamide Formula: C21H20FN5O3S MolecularWeight: 441.478603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=C(C=N2)NC(=O)C3=CC=CC=C3F)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=C(C=N2)NC(=O)C3=CC=CC=C3F)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H20FN5O3S/c22-17-5-2-1-4-16(17)20(29)24-15-12-23-27(13-15)14-19(28)25-7-9-26(10-8-25)21(30)18-6-3-11-31-18/h1-6,11-13H,7-10,14H2,(H,24,29)