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

Systemtic Name: (2S)-2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-[2-(2-fluorophenyl)ethyl]propanamide Openeye Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[2-(2-fluorophenyl)ethyl]propanamide CAS Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[2-(2-fluorophenyl)ethyl]propanamide IUPAC Name: (2S)-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-N-[2-(2-fluorophenyl)ethyl]propanamide Traditional Name: (2S)-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]-N-[2-(2-fluorophenyl)ethyl]propionamide Formula: C18H18FN3O3S MolecularWeight: 375.417223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC=CC=C1F)NC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CC=CC=C1F)NC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H18FN3O3S/c1-12(18(23)20-11-10-13-6-2-4-8-15(13)19)21-17-14-7-3-5-9-16(14)26(24,25)22-17/h2-9,12H,10-11H2,1H3,(H,20,23)(H,21,22)/t12-/m0/s1