4-chloranyl-6-fluoranyl-7-isocyanato-2-pyrrolidin-1-yl-1,3-benzothiazole

Systemtic Name: 4-chloranyl-6-fluoranyl-7-isocyanato-2-pyrrolidin-1-yl-1,3-benzothiazole Openeye Name: 4-chloro-6-fluoro-7-isocyanato-2-pyrrolidin-1-yl-1,3-benzothiazole CAS Name: 4-chloro-6-fluoro-7-isocyanato-2-(1-pyrrolidinyl)-1,3-benzothiazole IUPAC Name: 4-chloro-6-fluoro-7-isocyanato-2-pyrrolidin-1-yl-1,3-benzothiazole Traditional Name: 4-chloro-6-fluoro-7-isocyanato-2-pyrrolidino-1,3-benzothiazole Formula: C12H9ClFN3OS MolecularWeight: 297.735763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(C=C(C(=C3S2)N=C=O)F)Cl

Isomeric SMILES

C1CCN(C1)C2=NC3=C(C=C(C(=C3S2)N=C=O)F)Cl

InChI

InChI=1S/C12H9ClFN3OS/c13-7-5-8(14)10(15-6-18)11-9(7)16-12(19-11)17-3-1-2-4-17/h5H,1-4H2