methyl 2-[6-fluoranyl-2-[2-[2-oxidanylidene-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-fluoranyl-2-[2-[2-oxidanylidene-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-fluoro-2-[2-[2-oxo-2-[(4-phenylthiazol-2-yl)amino]ethyl]sulfanylacetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-fluoro-2-[1-oxo-2-[[2-oxo-2-[(4-phenyl-2-thiazolyl)amino]ethyl]thio]ethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-fluoro-2-[2-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]sulfanylacetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-fluoro-2-[2-[[2-keto-2-[(4-phenylthiazol-2-yl)amino]ethyl]thio]acetyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H19FN4O4S3 MolecularWeight: 530.614763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)NC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CN1C2=C(C=C(C=C2)F)SC1=NC(=O)CSCC(=O)NC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H19FN4O4S3/c1-32-21(31)10-28-17-8-7-15(24)9-18(17)35-23(28)27-20(30)13-33-12-19(29)26-22-25-16(11-34-22)14-5-3-2-4-6-14/h2-9,11H,10,12-13H2,1H3,(H,25,26,29)