N-[1-[[1-(4-chloranyl-2-fluoranyl-phenyl)-3-oxidanylidene-piperidin-4-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[1-[[1-(4-chloranyl-2-fluoranyl-phenyl)-3-oxidanylidene-piperidin-4-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[1-[[1-(4-chloro-2-fluoro-phenyl)-3-oxo-4-piperidyl]carbamoyl]cyclohexyl]benzothiophene-2-carboxamide CAS Name: N-[1-[[[1-(4-chloro-2-fluorophenyl)-3-oxo-4-piperidinyl]amino]-oxomethyl]cyclohexyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-[[1-(4-chloro-2-fluorophenyl)-3-oxopiperidin-4-yl]carbamoyl]cyclohexyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[1-[[1-(4-chloro-2-fluoro-phenyl)-3-keto-4-piperidyl]carbamoyl]cyclohexyl]benzothiophene-2-carboxamide Formula: C27H27ClFN3O3S MolecularWeight: 528.037983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NC2CCN(CC2=O)C3=C(C=C(C=C3)Cl)F)NC(=O)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CCC(CC1)(C(=O)NC2CCN(CC2=O)C3=C(C=C(C=C3)Cl)F)NC(=O)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C27H27ClFN3O3S/c28-18-8-9-21(19(29)15-18)32-13-10-20(22(33)16-32)30-26(35)27(11-4-1-5-12-27)31-25(34)24-14-17-6-2-3-7-23(17)36-24/h2-3,6-9,14-15,20H,1,4-5,10-13,16H2,(H,30,35)(H,31,34)