N-(1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfanyl-N-(3-morpholinopropyl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(4-fluorophenyl)thio]-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(4-fluorophenyl)thio]-N-(3-morpholinopropyl)acetamide Formula: C22H24FN3O2S2 MolecularWeight: 445.573263

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=CC=CC=C3S2)C(=O)CSC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=CC=CC=C3S2)C(=O)CSC4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O2S2/c23-17-6-8-18(9-7-17)29-16-21(27)26(11-3-10-25-12-14-28-15-13-25)22-24-19-4-1-2-5-20(19)30-22/h1-2,4-9H,3,10-16H2