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

Systemtic Name: ethyl 3-ethyl-2-[2-(4-methoxyphenyl)sulfanylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 3-ethyl-2-[2-(4-methoxyphenyl)sulfanylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-ethyl-2-[2-[(4-methoxyphenyl)thio]-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-2-[2-(4-methoxyphenyl)sulfanylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-ethyl-2-[2-[(4-methoxyphenyl)thio]acetyl]imino-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)SC1=NC(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O4S2/c1-4-23-17-11-6-14(20(25)27-5-2)12-18(17)29-21(23)22-19(24)13-28-16-9-7-15(26-3)8-10-16/h6-12H,4-5,13H2,1-3H3