N-(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide

Systemtic Name: N-(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide Openeye Name: N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide CAS Name: N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide IUPAC Name: N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide Traditional Name: N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O5S/c1-5-27-16-8-12(9-17(28-6-2)19(16)29-7-3)20(25)24-21-23-14-10-13(22)15(26-4)11-18(14)30-21/h8-11H,5-7H2,1-4H3,(H,23,24,25)