N-[4,7-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-ethylsulfonyl-benzamide

Systemtic Name: N-[4,7-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-ethylsulfonyl-benzamide Openeye Name: N-[4,7-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-ethylsulfonyl-benzamide CAS Name: N-[4,7-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-ethylsulfonylbenzamide IUPAC Name: N-[4,7-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-ethylsulfonylbenzamide Traditional Name: N-[4,7-dimethoxy-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-esyl-benzamide Formula: C21H24N2O6S2 MolecularWeight: 464.55506

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N=C2N(C3=C(C=CC(=C3S2)OC)OC)CCOC

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N=C2N(C3=C(C=CC(=C3S2)OC)OC)CCOC

InChI

InChI=1S/C21H24N2O6S2/c1-5-31(25,26)17-9-7-6-8-14(17)20(24)22-21-23(12-13-27-2)18-15(28-3)10-11-16(29-4)19(18)30-21/h6-11H,5,12-13H2,1-4H3