N-(2-diethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonyl-benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonyl-benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonyl-benzamide CAS Name: N-(2-diethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonylbenzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-ethylsulfonylbenzamide Traditional Name: N-(2-diethylaminoethyl)-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-esyl-benzamide Formula: C24H31N3O3S2 MolecularWeight: 473.65124

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(C=C(C=C2S1)C)C)C(=O)C3=CC=CC=C3S(=O)(=O)CC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(C=C(C=C2S1)C)C)C(=O)C3=CC=CC=C3S(=O)(=O)CC

InChI

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