N-[3-(2-methoxyethyl)-5,6-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide

Systemtic Name: N-[3-(2-methoxyethyl)-5,6-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide Openeye Name: N-[3-(2-methoxyethyl)-5,6-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonyl-benzamide CAS Name: N-[3-(2-methoxyethyl)-5,6-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonylbenzamide IUPAC Name: N-[3-(2-methoxyethyl)-5,6-dimethyl-1,3-benzothiazol-2-ylidene]-2-methylsulfonylbenzamide Traditional Name: 2-mesyl-N-[3-(2-methoxyethyl)-5,6-dimethyl-1,3-benzothiazol-2-ylidene]benzamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC=CC=C3S(=O)(=O)C)N2CCOC

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)C3=CC=CC=C3S(=O)(=O)C)N2CCOC

InChI

InChI=1S/C20H22N2O4S2/c1-13-11-16-17(12-14(13)2)27-20(22(16)9-10-26-3)21-19(23)15-7-5-6-8-18(15)28(4,24)25/h5-8,11-12H,9-10H2,1-4H3