2,4-bis(fluoranyl)-N-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 2,4-bis(fluoranyl)-N-[6-(4-thiophen-2-ylcarbonylpiperazin-1-yl)pyridin-3-yl]benzamide Openeye Name: 2,4-difluoro-N-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]-3-pyridyl]benzamide CAS Name: 2,4-difluoro-N-[6-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-3-pyridinyl]benzamide IUPAC Name: 2,4-difluoro-N-[6-[4-(thiophene-2-carbonyl)piperazin-1-yl]pyridin-3-yl]benzamide Traditional Name: 2,4-difluoro-N-[6-[4-(2-thenoyl)piperazino]-3-pyridyl]benzamide Formula: C21H18F2N4O2S MolecularWeight: 428.455026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=C(C=C(C=C3)F)F)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=C(C=C(C=C3)F)F)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H18F2N4O2S/c22-14-3-5-16(17(23)12-14)20(28)25-15-4-6-19(24-13-15)26-7-9-27(10-8-26)21(29)18-2-1-11-30-18/h1-6,11-13H,7-10H2,(H,25,28)