N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-4-(4-fluorophenyl)sulfanyl-butanamide

Systemtic Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-4-(4-fluorophenyl)sulfanyl-butanamide Openeye Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-4-(4-fluorophenyl)sulfanyl-butanamide CAS Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-fluorophenyl)thio]butanamide IUPAC Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-4-(4-fluorophenyl)sulfanylbutanamide Traditional Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-fluorophenyl)thio]butyramide Formula: C21H23FN2O2S2 MolecularWeight: 418.547923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)F)C)OC

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)F)C)OC

InChI

InChI=1S/C21H23FN2O2S2/c1-4-24-19-17(26-3)12-7-14(2)20(19)28-21(24)23-18(25)6-5-13-27-16-10-8-15(22)9-11-16/h7-12H,4-6,13H2,1-3H3