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

Systemtic Name: N-(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide Openeye Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide CAS Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide IUPAC Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxybenzamide Traditional Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-3,4,5-triethoxy-benzamide Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(S2)C=C(C(=C3)Cl)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NC3=C(S2)C=C(C(=C3)Cl)C

InChI

InChI=1S/C21H23ClN2O4S/c1-5-26-16-9-13(10-17(27-6-2)19(16)28-7-3)20(25)24-21-23-15-11-14(22)12(4)8-18(15)29-21/h8-11H,5-7H2,1-4H3,(H,23,24,25)