(2S)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-2-(phenylsulfonylamino)propanamide

Systemtic Name: (2S)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-2-(phenylsulfonylamino)propanamide Openeye Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]propanamide CAS Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]propanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]propanamide Traditional Name: (2S)-2-(benzenesulfonamido)-N-[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]propionamide Formula: C18H18N4O4S2 MolecularWeight: 418.48992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(=O)NC1=NC2=CC=CC=C2S1)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC(=O)NC1=NC2=CC=CC=C2S1)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O4S2/c1-12(22-28(25,26)13-7-3-2-4-8-13)17(24)19-11-16(23)21-18-20-14-9-5-6-10-15(14)27-18/h2-10,12,22H,11H2,1H3,(H,19,24)(H,20,21,23)/t12-/m0/s1