N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: N-[2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]benzamide IUPAC Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]benzamide Traditional Name: N-[2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-16-8-9-19(14-17(16)2)29(27,28)24-12-10-23(11-13-24)20(25)15-22-21(26)18-6-4-3-5-7-18/h3-9,14H,10-13,15H2,1-2H3,(H,22,26)