3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-N,N-dimethyl-benzotriazole-5-sulfonamide

Systemtic Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-N,N-dimethyl-benzotriazole-5-sulfonamide Openeye Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-ethoxy]-N,N-dimethyl-benzotriazole-5-sulfonamide CAS Name: 3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethoxy]-N,N-dimethyl-5-benzotriazolesulfonamide IUPAC Name: 3-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethoxy]-N,N-dimethylbenzotriazole-5-sulfonamide Traditional Name: 3-[2-keto-2-[4-(4-methoxyphenyl)piperazino]ethoxy]-N,N-dimethyl-benzotriazole-5-sulfonamide Formula: C21H26N6O5S MolecularWeight: 474.53334

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H26N6O5S/c1-24(2)33(29,30)18-8-9-19-20(14-18)27(23-22-19)32-15-21(28)26-12-10-25(11-13-26)16-4-6-17(31-3)7-5-16/h4-9,14H,10-13,15H2,1-3H3