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

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)butanamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-N-(3-morpholinopropyl)butanamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]-N-[3-(4-morpholinyl)propyl]butanamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)butanamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]-N-(3-morpholinopropyl)butyramide Formula: C26H32FN3O2S2 MolecularWeight: 501.679583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)CCCSC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCCN3CCOCC3)C(=O)CCCSC4=CC=C(C=C4)F

InChI

InChI=1S/C26H32FN3O2S2/c1-2-20-6-3-7-23-25(20)28-26(34-23)30(14-5-13-29-15-17-32-18-16-29)24(31)8-4-19-33-22-11-9-21(27)10-12-22/h3,6-7,9-12H,2,4-5,8,13-19H2,1H3