ethyl 2-[2-[2-(4-methylsulfanylphenyl)ethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(4-methylsulfanylphenyl)ethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(4-methylsulfanylphenyl)acetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-[4-(methylthio)phenyl]-1-oxoethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-methylsulfanylphenyl)acetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-[4-(methylthio)phenyl]acetyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2SC1=NC(=O)CC3=CC=C(C=C3)SC

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2SC1=NC(=O)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H20N2O3S2/c1-3-25-19(24)13-22-16-6-4-5-7-17(16)27-20(22)21-18(23)12-14-8-10-15(26-2)11-9-14/h4-11H,3,12-13H2,1-2H3