N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonyl-benzamide

Systemtic Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonyl-benzamide Openeye Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonyl-benzamide CAS Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonylbenzamide IUPAC Name: N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)-3-ethylsulfonylbenzamide Traditional Name: 3-esyl-N-(3-ethyl-4-methoxy-7-methyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC(=CC=C3)S(=O)(=O)CC)C)OC

Isomeric SMILES

CCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC(=CC=C3)S(=O)(=O)CC)C)OC

InChI

InChI=1S/C20H22N2O4S2/c1-5-22-17-16(26-4)11-10-13(3)18(17)27-20(22)21-19(23)14-8-7-9-15(12-14)28(24,25)6-2/h7-12H,5-6H2,1-4H3