[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium

Systemtic Name: [(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium Openeye Name: [(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-(3-oxo-3-pyrrolidin-1-yl-propyl)ammonium CAS Name: [(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-[3-oxo-3-(1-pyrrolidinyl)propyl]ammonium IUPAC Name: [(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-(3-oxo-3-pyrrolidin-1-ylpropyl)azanium Traditional Name: [(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-(3-keto-3-pyrrolidino-propyl)ammonium Formula: C16H22N3OS+ MolecularWeight: 304.43038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)[NH2+]CCC(=O)N3CCCC3

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2S1)[NH2+]CCC(=O)N3CCCC3

InChI

InChI=1S/C16H21N3OS/c1-12(16-18-13-6-2-3-7-14(13)21-16)17-9-8-15(20)19-10-4-5-11-19/h2-3,6-7,12,17H,4-5,8-11H2,1H3/p+1/t12-/m0/s1