N-(2-dimethylaminoethyl)-3,4-dimethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-3,4-dimethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-dimethylaminoethyl)-3,4-dimethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-dimethylaminoethyl)-3,4-dimethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: N-(2-dimethylaminoethyl)-3,4-dimethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-dimethylaminoethyl)-N-(6-mesyl-1,3-benzothiazol-2-yl)-3,4-dimethoxy-benzamide Formula: C21H25N3O5S2 MolecularWeight: 463.5703

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(C)CCN(C1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H25N3O5S2/c1-23(2)10-11-24(20(25)14-6-9-17(28-3)18(12-14)29-4)21-22-16-8-7-15(31(5,26)27)13-19(16)30-21/h6-9,12-13H,10-11H2,1-5H3