1-[5-chloranyl-2-[2-[4-cyano-4-(4-fluorophenyl)carbonyl-piperidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]urea

Systemtic Name: 1-[5-chloranyl-2-[2-[4-cyano-4-(4-fluorophenyl)carbonyl-piperidin-1-yl]-2-oxidanylidene-ethoxy]phenyl]urea Openeye Name: [5-chloro-2-[2-[4-cyano-4-(4-fluorobenzoyl)-1-piperidyl]-2-oxo-ethoxy]phenyl]urea CAS Name: [5-chloro-2-[2-[4-cyano-4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]-2-oxoethoxy]phenyl]urea IUPAC Name: [5-chloro-2-[2-[4-cyano-4-(4-fluorobenzoyl)piperidin-1-yl]-2-oxoethoxy]phenyl]urea Traditional Name: [5-chloro-2-[2-[4-cyano-4-(4-fluorobenzoyl)piperidino]-2-keto-ethoxy]phenyl]urea Formula: C22H20ClFN4O4 MolecularWeight: 458.870003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C#N)C(=O)C2=CC=C(C=C2)F)C(=O)COC3=C(C=C(C=C3)Cl)NC(=O)N

Isomeric SMILES

C1CN(CCC1(C#N)C(=O)C2=CC=C(C=C2)F)C(=O)COC3=C(C=C(C=C3)Cl)NC(=O)N

InChI

InChI=1S/C22H20ClFN4O4/c23-15-3-6-18(17(11-15)27-21(26)31)32-12-19(29)28-9-7-22(13-25,8-10-28)20(30)14-1-4-16(24)5-2-14/h1-6,11H,7-10,12H2,(H3,26,27,31)