N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-chloranyl-4-(diethylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-chloro-4-[diethylamino(oxo)methyl]phenyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-chloro-4-(diethylcarbamoyl)phenyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C23H27ClFN3O4S MolecularWeight: 495.994583

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C23H27ClFN3O4S/c1-3-27(4-2)23(30)20-10-7-18(15-21(20)24)26-22(29)16-11-13-28(14-12-16)33(31,32)19-8-5-17(25)6-9-19/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,26,29)