ethyl 2-[2-[3-(4-methoxyphenyl)sulfanylpropanoylimino]-5,7-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-(4-methoxyphenyl)sulfanylpropanoylimino]-5,7-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[3-(4-methoxyphenyl)sulfanylpropanoylimino]-5,7-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[3-[(4-methoxyphenyl)thio]-1-oxopropyl]imino-5,7-dimethyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(4-methoxyphenyl)sulfanylpropanoylimino]-5,7-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[3-[(4-methoxyphenyl)thio]propanoylimino]-5,7-dimethyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC(=CC(=C2SC1=NC(=O)CCSC3=CC=C(C=C3)OC)C)C

Isomeric SMILES

CCOC(=O)CN1C2=CC(=CC(=C2SC1=NC(=O)CCSC3=CC=C(C=C3)OC)C)C

InChI

InChI=1S/C23H26N2O4S2/c1-5-29-21(27)14-25-19-13-15(2)12-16(3)22(19)31-23(25)24-20(26)10-11-30-18-8-6-17(28-4)7-9-18/h6-9,12-13H,5,10-11,14H2,1-4H3