N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfonyl-benzamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfonyl-benzamide Openeye Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfonyl-benzamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfonylbenzamide IUPAC Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-ethylsulfonylbenzamide Traditional Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-3-esyl-benzamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=NC3=C(C=CC(=C3S2)OC)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC(=C1)C(=O)N(CCN(C)C)C2=NC3=C(C=CC(=C3S2)OC)OC

InChI

InChI=1S/C22H27N3O5S2/c1-6-32(27,28)16-9-7-8-15(14-16)21(26)25(13-12-24(2)3)22-23-19-17(29-4)10-11-18(30-5)20(19)31-22/h7-11,14H,6,12-13H2,1-5H3