3-chloranyl-5-ethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-propoxy-benzamide

Systemtic Name: 3-chloranyl-5-ethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-propoxy-benzamide Openeye Name: 3-chloro-5-ethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-propoxy-benzamide CAS Name: 3-chloro-5-ethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-propoxybenzamide IUPAC Name: 3-chloro-5-ethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-propoxybenzamide Traditional Name: 3-chloro-5-ethoxy-N-(6-mesyl-1,3-benzothiazol-2-yl)-4-propoxy-benzamide Formula: C20H21ClN2O5S2 MolecularWeight: 468.97414

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)OCC

InChI

InChI=1S/C20H21ClN2O5S2/c1-4-8-28-18-14(21)9-12(10-16(18)27-5-2)19(24)23-20-22-15-7-6-13(30(3,25)26)11-17(15)29-20/h6-7,9-11H,4-5,8H2,1-3H3,(H,22,23,24)