(2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-cyclopropyl-hexanamide

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-cyclopropyl-hexanamide Openeye Name: (2S)-N-cyclopropyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide CAS Name: (2S)-N-cyclopropyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide IUPAC Name: (2S)-N-cyclopropyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]hexanamide Traditional Name: (2S)-N-cyclopropyl-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]hexanamide Formula: C16H21N3O3S MolecularWeight: 335.42124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC1CC1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCC[C@@H](C(=O)NC1CC1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H21N3O3S/c1-2-3-7-13(16(20)17-11-9-10-11)18-15-12-6-4-5-8-14(12)23(21,22)19-15/h4-6,8,11,13H,2-3,7,9-10H2,1H3,(H,17,20)(H,18,19)/t13-/m0/s1