N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C17H22FN3O4S MolecularWeight: 383.437683

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC(=O)NC3CC3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCC(=O)NC3CC3

InChI

InChI=1S/C17H22FN3O4S/c18-13-3-7-15(8-4-13)26(24,25)21-9-1-2-12(11-21)17(23)19-10-16(22)20-14-5-6-14/h3-4,7-8,12,14H,1-2,5-6,9-11H2,(H,19,23)(H,20,22)