N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide

Systemtic Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide Openeye Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide CAS Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonylbenzamide IUPAC Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonylbenzamide Traditional Name: N-[3-(2-ethoxyethyl)-5,7-dimethyl-1,3-benzothiazol-2-ylidene]-2-mesyl-benzamide Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC(=CC(=C2SC1=NC(=O)C3=CC=CC=C3S(=O)(=O)C)C)C

Isomeric SMILES

CCOCCN1C2=CC(=CC(=C2SC1=NC(=O)C3=CC=CC=C3S(=O)(=O)C)C)C

InChI

InChI=1S/C21H24N2O4S2/c1-5-27-11-10-23-17-13-14(2)12-15(3)19(17)28-21(23)22-20(24)16-8-6-7-9-18(16)29(4,25)26/h6-9,12-13H,5,10-11H2,1-4H3