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

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(2-pyridylmethyl)propanamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]-N-(2-pyridinylmethyl)propanamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)propanamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]-N-(2-pyridylmethyl)propionamide Formula: C24H22FN3OS2 MolecularWeight: 451.579383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=N3)C(=O)CCSC4=CC=C(C=C4)F

InChI

InChI=1S/C24H22FN3OS2/c1-2-17-6-5-8-21-23(17)27-24(31-21)28(16-19-7-3-4-14-26-19)22(29)13-15-30-20-11-9-18(25)10-12-20/h3-12,14H,2,13,15-16H2,1H3