N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-2-phenoxy-ethanamide Openeye Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-2-phenoxy-acetamide CAS Name: N-[2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-phenoxyacetamide IUPAC Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-2-phenoxyacetamide Traditional Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]-2-phenoxy-acetamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5S/c1-17-8-9-18(2)20(14-17)31(28,29)25-12-10-24(11-13-25)22(27)15-23-21(26)16-30-19-6-4-3-5-7-19/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,26)