N-[3-(2-ethoxyethyl)-4-fluoranyl-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanyl-butanamide

Systemtic Name: N-[3-(2-ethoxyethyl)-4-fluoranyl-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanyl-butanamide Openeye Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanyl-butanamide CAS Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-4-[(4-fluorophenyl)thio]butanamide IUPAC Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-4-(4-fluorophenyl)sulfanylbutanamide Traditional Name: N-[3-(2-ethoxyethyl)-4-fluoro-1,3-benzothiazol-2-ylidene]-4-[(4-fluorophenyl)thio]butyramide Formula: C21H22F2N2O2S2 MolecularWeight: 436.538386

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=CC=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)F)F

Isomeric SMILES

CCOCCN1C2=C(C=CC=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)F)F

InChI

InChI=1S/C21H22F2N2O2S2/c1-2-27-13-12-25-20-17(23)5-3-6-18(20)29-21(25)24-19(26)7-4-14-28-16-10-8-15(22)9-11-16/h3,5-6,8-11H,2,4,7,12-14H2,1H3