N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-[3-(2-methoxyethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-[6-mesyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[(4-methoxyphenyl)thio]acetamide Formula: C20H22N2O5S3 MolecularWeight: 466.59408

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

COCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N2O5S3/c1-26-11-10-22-17-9-8-16(30(3,24)25)12-18(17)29-20(22)21-19(23)13-28-15-6-4-14(27-2)5-7-15/h4-9,12H,10-11,13H2,1-3H3