[4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxo-butyl]ammonium CAS Name: [4-[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-4-oxobutyl]ammonium IUPAC Name: [4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-4-oxobutyl]azanium Traditional Name: [4-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidino]-4-keto-butyl]ammonium Formula: C15H20N3OS+ MolecularWeight: 290.4038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC[NH3+])C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCC[NH3+])C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H19N3OS/c16-9-3-8-14(19)18-10-4-6-12(18)15-17-11-5-1-2-7-13(11)20-15/h1-2,5,7,12H,3-4,6,8-10,16H2/p+1/t12-/m0/s1