methyl 3-(2-ethoxyethyl)-2-[2-(4-ethylsulfanylphenyl)ethanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-ethoxyethyl)-2-[2-(4-ethylsulfanylphenyl)ethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-ethoxyethyl)-2-[2-(4-ethylsulfanylphenyl)acetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxyethyl)-2-[2-[4-(ethylthio)phenyl]-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-ethoxyethyl)-2-[2-(4-ethylsulfanylphenyl)acetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxyethyl)-2-[2-[4-(ethylthio)phenyl]acetyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CC3=CC=C(C=C3)SCC

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CC3=CC=C(C=C3)SCC

InChI

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