N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C19H25FN2O3S MolecularWeight: 380.476803

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H25FN2O3S/c1-4-19(5-2,6-3)21-18(23)15-8-7-13-22(14-15)26(24,25)17-11-9-16(20)10-12-17/h1,9-12,15H,5-8,13-14H2,2-3H3,(H,21,23)