ethyl 2-[2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[3-(4-methoxyphenyl)sulfonyl-1-oxopropyl]imino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[3-(4-methoxyphenyl)sulfonylpropanoylimino]-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C22H24N2O6S3 MolecularWeight: 508.63076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O6S3/c1-4-30-21(26)14-24-18-10-7-16(31-3)13-19(18)32-22(24)23-20(25)11-12-33(27,28)17-8-5-15(29-2)6-9-17/h5-10,13H,4,11-12,14H2,1-3H3