methyl 3-(2-ethoxyethyl)-2-[2-(4-methoxyphenyl)sulfanylethanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-ethoxyethyl)-2-[2-(4-methoxyphenyl)sulfanylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-ethoxyethyl)-2-[2-(4-methoxyphenyl)sulfanylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxyethyl)-2-[2-[(4-methoxyphenyl)thio]-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-ethoxyethyl)-2-[2-(4-methoxyphenyl)sulfanylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxyethyl)-2-[2-[(4-methoxyphenyl)thio]acetyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C22H24N2O5S2 MolecularWeight: 460.56636

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O5S2/c1-4-29-12-11-24-18-10-5-15(21(26)28-3)13-19(18)31-22(24)23-20(25)14-30-17-8-6-16(27-2)7-9-17/h5-10,13H,4,11-12,14H2,1-3H3