N-(azepan-1-yl)-2-[1-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(azepan-1-yl)-2-[1-(2-chloranyl-6-fluoranyl-phenyl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(azepan-1-yl)-2-[1-(2-chloro-6-fluoro-benzoyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(1-azepanyl)-2-[1-[(2-chloro-6-fluorophenyl)-oxomethyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(azepan-1-yl)-2-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(azepan-1-yl)-2-[1-(2-chloro-6-fluoro-benzoyl)-4-piperidyl]thiazole-4-carboxamide Formula: C22H26ClFN4O2S MolecularWeight: 464.983843

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCCN(CC1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H26ClFN4O2S/c23-16-6-5-7-17(24)19(16)22(30)27-12-8-15(9-13-27)21-25-18(14-31-21)20(29)26-28-10-3-1-2-4-11-28/h5-7,14-15H,1-4,8-13H2,(H,26,29)