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

Systemtic Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]cyclohexanecarboxamide Openeye Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-[2-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]cyclohexanecarboxamide IUPAC Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]cyclohexanecarboxamide Traditional Name: N-[2-[4-(2,5-dimethylphenyl)sulfonylpiperazino]-2-keto-ethyl]cyclohexanecarboxamide Formula: C21H31N3O4S MolecularWeight: 421.55354

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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)C3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)CNC(=O)C3CCCCC3

InChI

InChI=1S/C21H31N3O4S/c1-16-8-9-17(2)19(14-16)29(27,28)24-12-10-23(11-13-24)20(25)15-22-21(26)18-6-4-3-5-7-18/h8-9,14,18H,3-7,10-13,15H2,1-2H3,(H,22,26)