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

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-cycloheptyl-propanamide Openeye Name: (2S)-N-cycloheptyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide CAS Name: (2S)-N-cycloheptyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide IUPAC Name: (2S)-N-cycloheptyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide Traditional Name: (2S)-N-cycloheptyl-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionamide Formula: C17H23N3O3S MolecularWeight: 349.44782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCCC1)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H23N3O3S/c1-12(17(21)19-13-8-4-2-3-5-9-13)18-16-14-10-6-7-11-15(14)24(22,23)20-16/h6-7,10-13H,2-5,8-9H2,1H3,(H,18,20)(H,19,21)/t12-/m0/s1