N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide CAS Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-3-ethylsulfonylbenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4-ethoxy-1,3-benzothiazol-2-yl)-3-ethylsulfonylbenzamide Traditional Name: N-(2-diethylaminoethyl)-3-esyl-N-(4-ethoxy-1,3-benzothiazol-2-yl)benzamide Formula: C24H31N3O4S2 MolecularWeight: 489.65064

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=CC=C2S1)OCC)C(=O)C3=CC(=CC=C3)S(=O)(=O)CC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=CC=C2S1)OCC)C(=O)C3=CC(=CC=C3)S(=O)(=O)CC

InChI

InChI=1S/C24H31N3O4S2/c1-5-26(6-2)15-16-27(23(28)18-11-9-12-19(17-18)33(29,30)8-4)24-25-22-20(31-7-3)13-10-14-21(22)32-24/h9-14,17H,5-8,15-16H2,1-4H3