N-[(2S)-1-(2,2-dimethylhydrazinyl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(2S)-1-(2,2-dimethylhydrazinyl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(1S)-1-(dimethylaminocarbamoyl)-3-methylsulfanyl-propyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(2S)-1-(2,2-dimethylhydrazinyl)-4-(methylthio)-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(2S)-1-(2,2-dimethylhydrazinyl)-4-methylsulfanyl-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(1S)-1-(dimethylaminocarbamoyl)-3-(methylthio)propyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C15H23N3O5S2 MolecularWeight: 389.49022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC(=O)C(CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CN(C)NC(=O)[C@H](CCSC)NS(=O)(=O)C1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C15H23N3O5S2/c1-18(2)16-15(19)12(6-9-24-3)17-25(20,21)11-4-5-13-14(10-11)23-8-7-22-13/h4-5,10,12,17H,6-9H2,1-3H3,(H,16,19)/t12-/m0/s1