N-(5-chloranylpyridin-2-yl)-5-fluoranyl-2-[[1-(thian-4-yl)piperidin-4-yl]methylamino]benzamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-5-fluoranyl-2-[[1-(thian-4-yl)piperidin-4-yl]methylamino]benzamide Openeye Name: N-(5-chloro-2-pyridyl)-5-fluoro-2-[(1-tetrahydrothiopyran-4-yl-4-piperidyl)methylamino]benzamide CAS Name: N-(5-chloro-2-pyridinyl)-5-fluoro-2-[[1-(4-thianyl)-4-piperidinyl]methylamino]benzamide IUPAC Name: N-(5-chloropyridin-2-yl)-5-fluoro-2-[[1-(thian-4-yl)piperidin-4-yl]methylamino]benzamide Traditional Name: N-(5-chloro-2-pyridyl)-5-fluoro-2-[(1-tetrahydrothiopyran-4-yl-4-piperidyl)methylamino]benzamide Formula: C23H28ClFN4OS MolecularWeight: 463.011023

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=C(C=C(C=C2)F)C(=O)NC3=NC=C(C=C3)Cl)C4CCSCC4

Isomeric SMILES

C1CN(CCC1CNC2=C(C=C(C=C2)F)C(=O)NC3=NC=C(C=C3)Cl)C4CCSCC4

InChI

InChI=1S/C23H28ClFN4OS/c24-17-1-4-22(27-15-17)28-23(30)20-13-18(25)2-3-21(20)26-14-16-5-9-29(10-6-16)19-7-11-31-12-8-19/h1-4,13,15-16,19,26H,5-12,14H2,(H,27,28,30)