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

Systemtic Name: 3,5-bis(chloranyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-pentoxy-benzamide Openeye Name: 3,5-dichloro-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-pentoxy-benzamide CAS Name: 3,5-dichloro-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-pentoxybenzamide IUPAC Name: 3,5-dichloro-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-pentoxybenzamide Traditional Name: 4-amoxy-3,5-dichloro-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C20H20Cl2N2O4S2 MolecularWeight: 487.4198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H20Cl2N2O4S2/c1-3-4-5-8-28-18-14(21)9-12(10-15(18)22)19(25)24-20-23-16-7-6-13(30(2,26)27)11-17(16)29-20/h6-7,9-11H,3-5,8H2,1-2H3,(H,23,24,25)