N-(3-ethylpent-1-yn-3-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-3-(4-piperidinosulfonylphenyl)propionamide Formula: C21H30N2O3S MolecularWeight: 390.5395

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C21H30N2O3S/c1-4-21(5-2,6-3)22-20(24)15-12-18-10-13-19(14-11-18)27(25,26)23-16-8-7-9-17-23/h1,10-11,13-14H,5-9,12,15-17H2,2-3H3,(H,22,24)