N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(3-allyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(4,6-difluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(4,6-difluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(3-allyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butyramide Formula: C21H20F2N2O2S2 MolecularWeight: 434.522506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCCC(=O)N=C2N(C3=C(C=C(C=C3S2)F)F)CC=C

Isomeric SMILES

COC1=CC=C(C=C1)SCCCC(=O)N=C2N(C3=C(C=C(C=C3S2)F)F)CC=C

InChI

InChI=1S/C21H20F2N2O2S2/c1-3-10-25-20-17(23)12-14(22)13-18(20)29-21(25)24-19(26)5-4-11-28-16-8-6-15(27-2)7-9-16/h3,6-9,12-13H,1,4-5,10-11H2,2H3