N-(6-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(3-morpholinopropyl)propanamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]-N-[3-(4-morpholinyl)propyl]propanamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-3-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-3-[(4-fluorophenyl)thio]-N-(3-morpholinopropyl)propionamide Formula: C25H30FN3O2S2 MolecularWeight: 487.653003

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)CCSC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)N(CCCN3CCOCC3)C(=O)CCSC4=CC=C(C=C4)F

InChI

InChI=1S/C25H30FN3O2S2/c1-2-19-4-9-22-23(18-19)33-25(27-22)29(12-3-11-28-13-15-31-16-14-28)24(30)10-17-32-21-7-5-20(26)6-8-21/h4-9,18H,2-3,10-17H2,1H3