N-(3-ethylpent-1-yn-3-yl)-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-4-(1-piperidylsulfonyl)benzamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-4-piperidinosulfonyl-benzamide Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O3S/c1-4-19(5-2,6-3)20-18(22)16-10-12-17(13-11-16)25(23,24)21-14-8-7-9-15-21/h1,10-13H,5-9,14-15H2,2-3H3,(H,20,22)