N-(3-ethylpent-1-yn-3-yl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H28N2O3S/c1-4-21(5-2,6-3)22-20(24)19-12-15-23(16-13-19)27(25,26)17-14-18-10-8-7-9-11-18/h1,7-11,14,17,19H,5-6,12-13,15-16H2,2-3H3,(H,22,24)/b17-14+