N-(3-imidazol-1-ylpropyl)-N'-[[(2S)-3-thiophen-2-ylsulfonyl-1,3-oxazinan-2-yl]methyl]ethanediamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-N'-[[(2S)-3-thiophen-2-ylsulfonyl-1,3-oxazinan-2-yl]methyl]ethanediamide Openeye Name: N-(3-imidazol-1-ylpropyl)-N'-[[(2S)-3-(2-thienylsulfonyl)-1,3-oxazinan-2-yl]methyl]oxamide CAS Name: N-[3-(1-imidazolyl)propyl]-N'-[[(2S)-3-thiophen-2-ylsulfonyl-1,3-oxazinan-2-yl]methyl]oxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-N'-[[(2S)-3-thiophen-2-ylsulfonyl-1,3-oxazinan-2-yl]methyl]oxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-N'-[[(2S)-3-(2-thienylsulfonyl)-1,3-oxazinan-2-yl]methyl]oxamide Formula: C17H23N5O5S2 MolecularWeight: 441.52502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(OC1)CNC(=O)C(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN([C@@H](OC1)CNC(=O)C(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H23N5O5S2/c23-16(19-5-2-7-21-9-6-18-13-21)17(24)20-12-14-22(8-3-10-27-14)29(25,26)15-4-1-11-28-15/h1,4,6,9,11,13-14H,2-3,5,7-8,10,12H2,(H,19,23)(H,20,24)/t14-/m0/s1