ethyl 2-[2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylimino]-6-bromanyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanoylimino]-6-bromanyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-bromo-2-[2-(1,3-dioxoisoindolin-2-yl)acetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-bromo-2-[2-(1,3-dioxo-2-isoindolyl)-1-oxoethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-bromo-2-[2-(1,3-dioxoisoindol-2-yl)acetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-bromo-2-(2-phthalimidoacetyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C21H16BrN3O5S MolecularWeight: 502.33784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H16BrN3O5S/c1-2-30-18(27)11-24-15-8-7-12(22)9-16(15)31-21(24)23-17(26)10-25-19(28)13-5-3-4-6-14(13)20(25)29/h3-9H,2,10-11H2,1H3