N-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(2-pyridylmethyl)propanamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]-N-(2-pyridinylmethyl)propanamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]-N-(2-pyridylmethyl)propionamide Formula: C22H17ClFN3OS2 MolecularWeight: 457.971283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN(C2=NC3=C(S2)C=CC=C3Cl)C(=O)CCSC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=NC(=C1)CN(C2=NC3=C(S2)C=CC=C3Cl)C(=O)CCSC4=CC=C(C=C4)F

InChI

InChI=1S/C22H17ClFN3OS2/c23-18-5-3-6-19-21(18)26-22(30-19)27(14-16-4-1-2-12-25-16)20(28)11-13-29-17-9-7-15(24)8-10-17/h1-10,12H,11,13-14H2