N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide

Systemtic Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide Openeye Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide CAS Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide IUPAC Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide Traditional Name: N-(4,7-dimethyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(C=CC(=C3S2)C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(C=CC(=C3S2)C)C

InChI

InChI=1S/C22H26N2O4S/c1-6-26-16-11-15(12-17(27-7-2)19(16)28-8-3)21(25)24-22-23-18-13(4)9-10-14(5)20(18)29-22/h9-12H,6-8H2,1-5H3,(H,23,24,25)