N-(2-diethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonyl-benzamide CAS Name: N-(2-diethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonylbenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-ethylsulfonylbenzamide Traditional Name: N-(2-diethylaminoethyl)-N-(5,7-dimethyl-1,3-benzothiazol-2-yl)-3-esyl-benzamide Formula: C24H31N3O3S2 MolecularWeight: 473.65124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O3S2/c1-6-26(7-2)12-13-27(24-25-21-15-17(4)14-18(5)22(21)31-24)23(28)19-10-9-11-20(16-19)32(29,30)8-3/h9-11,14-16H,6-8,12-13H2,1-5H3