(2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]propanamide Openeye Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[4-(2-oxo-1-pyrrolidinyl)phenyl]propanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-[4-(2-ketopyrrolidino)phenyl]propionamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=O)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)N2CCCC2=O)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H20N4O4S/c1-13(21-19-16-5-2-3-6-17(16)29(27,28)23-19)20(26)22-14-8-10-15(11-9-14)24-12-4-7-18(24)25/h2-3,5-6,8-11,13H,4,7,12H2,1H3,(H,21,23)(H,22,26)/t13-/m0/s1