(2S)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)propanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)propanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)propanoylamino]-N-ethyl-propanamide CAS Name: (2S)-2-[[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-1-oxopropyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)propanoylamino]-N-ethylpropanamide Traditional Name: (2S)-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)propanoylamino]-N-ethyl-propionamide Formula: C16H23N3O6S MolecularWeight: 385.43532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CCNS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CCNS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C16H23N3O6S/c1-3-17-16(21)11(2)19-15(20)6-7-18-26(22,23)12-4-5-13-14(10-12)25-9-8-24-13/h4-5,10-11,18H,3,6-9H2,1-2H3,(H,17,21)(H,19,20)/t11-/m0/s1