N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(p-tolylsulfonyl)acetamide CAS Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-[3-(dimethylamino)propyl]-N-(4-methoxy-1,3-benzothiazol-2-yl)-2-tosyl-acetamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N(CCCN(C)C)C2=NC3=C(C=CC=C3S2)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)N(CCCN(C)C)C2=NC3=C(C=CC=C3S2)OC

InChI

InChI=1S/C22H27N3O4S2/c1-16-9-11-17(12-10-16)31(27,28)15-20(26)25(14-6-13-24(2)3)22-23-21-18(29-4)7-5-8-19(21)30-22/h5,7-12H,6,13-15H2,1-4H3