N-(3-azanyl-3-oxidanylidene-propyl)-1-(4-fluorophenyl)sulfonyl-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: N-(3-azanyl-3-oxidanylidene-propyl)-1-(4-fluorophenyl)sulfonyl-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: N-(3-amino-3-oxo-propyl)-1-(4-fluorophenyl)sulfonyl-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: N-(3-amino-3-oxopropyl)-1-(4-fluorophenyl)sulfonyl-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: N-(3-amino-3-oxopropyl)-1-(4-fluorophenyl)sulfonyl-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: N-(3-amino-3-keto-propyl)-1-(4-fluorophenyl)sulfonyl-N-(2-methoxyphenyl)isonipecotamide Formula: C22H26FN3O5S MolecularWeight: 463.522343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(CCC(=O)N)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC=C1N(CCC(=O)N)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O5S/c1-31-20-5-3-2-4-19(20)26(15-12-21(24)27)22(28)16-10-13-25(14-11-16)32(29,30)18-8-6-17(23)7-9-18/h2-9,16H,10-15H2,1H3,(H2,24,27)