4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3-ethylpent-1-yn-3-yl)benzamide

Systemtic Name: 4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3-ethylpent-1-yn-3-yl)benzamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-benzamide CAS Name: 4-[[(2S,6S)-2,6-dimethyl-4-morpholinyl]sulfonyl]-N-(3-ethylpent-1-yn-3-yl)benzamide IUPAC Name: 4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(3-ethylpent-1-yn-3-yl)benzamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-4-[(2S,6S)-2,6-dimethylmorpholino]sulfonyl-benzamide Formula: C20H28N2O4S MolecularWeight: 392.51232

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC(OC(C2)C)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](O[C@H](C2)C)C

InChI

InChI=1S/C20H28N2O4S/c1-6-20(7-2,8-3)21-19(23)17-9-11-18(12-10-17)27(24,25)22-13-15(4)26-16(5)14-22/h1,9-12,15-16H,7-8,13-14H2,2-5H3,(H,21,23)/t15-,16-/m0/s1