methyl 2-[2-[4-(4-methoxyphenyl)sulfanylbutanoylimino]-5,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[4-(4-methoxyphenyl)sulfanylbutanoylimino]-5,6-dimethyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[4-(4-methoxyphenyl)sulfanylbutanoylimino]-5,6-dimethyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[4-[(4-methoxyphenyl)thio]-1-oxobutyl]imino-5,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[4-(4-methoxyphenyl)sulfanylbutanoylimino]-5,6-dimethyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[4-[(4-methoxyphenyl)thio]butanoylimino]-5,6-dimethyl-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)CCCSC3=CC=C(C=C3)OC)N2CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)CCCSC3=CC=C(C=C3)OC)N2CC(=O)OC

InChI

InChI=1S/C23H26N2O4S2/c1-15-12-19-20(13-16(15)2)31-23(25(19)14-22(27)29-4)24-21(26)6-5-11-30-18-9-7-17(28-3)8-10-18/h7-10,12-13H,5-6,11,14H2,1-4H3