N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-1-(3-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-1-(3-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[4-[(2-ethyl-1-piperidyl)sulfonyl]phenyl]-1-(3-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[4-[(2-ethyl-1-piperidinyl)sulfonyl]phenyl]-1-[(3-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-1-(3-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[4-(2-ethylpiperidino)sulfonylphenyl]-1-(3-fluorobenzoyl)isonipecotamide Formula: C26H32FN3O4S MolecularWeight: 501.613383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C26H32FN3O4S/c1-2-23-8-3-4-15-30(23)35(33,34)24-11-9-22(10-12-24)28-25(31)19-13-16-29(17-14-19)26(32)20-6-5-7-21(27)18-20/h5-7,9-12,18-19,23H,2-4,8,13-17H2,1H3,(H,28,31)