methyl 2-[2-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanylethanoylimino]-6-fluoranyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanylethanoylimino]-6-fluoranyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanylacetyl]imino-6-fluoro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-1-oxoethyl]imino-6-fluoro-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanylacetyl]imino-6-fluoro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]acetyl]imino-6-fluoro-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H22FN3O4S2 MolecularWeight: 487.566883

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C23H22FN3O4S2/c1-31-22(30)12-27-18-9-8-16(24)11-19(18)33-23(27)25-20(28)13-32-14-21(29)26-10-4-6-15-5-2-3-7-17(15)26/h2-3,5,7-9,11H,4,6,10,12-14H2,1H3