N-(4-fluoranyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: N-(4-fluoranyl-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(3-morpholinopropyl)benzamide CAS Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-4-(methylthio)-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-4-methylsulfanyl-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: N-(4-fluoro-1,3-benzothiazol-2-yl)-4-(methylthio)-N-(3-morpholinopropyl)benzamide Formula: C22H24FN3O2S2 MolecularWeight: 445.573263

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(C=CC=C4S3)F

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)N(CCCN2CCOCC2)C3=NC4=C(C=CC=C4S3)F

InChI

InChI=1S/C22H24FN3O2S2/c1-29-17-8-6-16(7-9-17)21(27)26(11-3-10-25-12-14-28-15-13-25)22-24-20-18(23)4-2-5-19(20)30-22/h2,4-9H,3,10-15H2,1H3