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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-N-(3-morpholinopropyl)butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]-N-[3-(4-morpholinyl)propyl]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(4-fluorophenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)thio]-N-(3-morpholinopropyl)butyramide Formula: C24H28FN3O2S2 MolecularWeight: 473.626423

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCN(C2=NC3=CC=CC=C3S2)C(=O)CCCSC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1CCCN(C2=NC3=CC=CC=C3S2)C(=O)CCCSC4=CC=C(C=C4)F

InChI

InChI=1S/C24H28FN3O2S2/c25-19-8-10-20(11-9-19)31-18-3-7-23(29)28(13-4-12-27-14-16-30-17-15-27)24-26-21-5-1-2-6-22(21)32-24/h1-2,5-6,8-11H,3-4,7,12-18H2