N-[6-acetamido-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanyl-butanamide

Systemtic Name: N-[6-acetamido-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanyl-butanamide Openeye Name: N-[6-acetamido-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanyl-butanamide CAS Name: N-[6-acetamido-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-[(4-fluorophenyl)thio]butanamide IUPAC Name: N-[6-acetamido-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanylbutanamide Traditional Name: N-[6-acetamido-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-4-[(4-fluorophenyl)thio]butyramide Formula: C22H24FN3O3S2 MolecularWeight: 461.572663

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)CCCSC3=CC=C(C=C3)F)S2)CCOC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)CCCSC3=CC=C(C=C3)F)S2)CCOC

InChI

InChI=1S/C22H24FN3O3S2/c1-15(27)24-17-7-10-19-20(14-17)31-22(26(19)11-12-29-2)25-21(28)4-3-13-30-18-8-5-16(23)6-9-18/h5-10,14H,3-4,11-13H2,1-2H3,(H,24,27)