N-[4-[2-[(cyclohexylcarbonylamino)-phenyl-amino]ethyl]piperazin-1-yl]-2-(4-methylsulfonylphenyl)ethanamide

Systemtic Name: N-[4-[2-[(cyclohexylcarbonylamino)-phenyl-amino]ethyl]piperazin-1-yl]-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-[4-[2-(N-(cyclohexanecarbonylamino)anilino)ethyl]piperazin-1-yl]-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-[4-[2-(N-[[cyclohexyl(oxo)methyl]amino]anilino)ethyl]-1-piperazinyl]-2-(4-methylsulfonylphenyl)acetamide IUPAC Name: N-[4-[2-(N-(cyclohexanecarbonylamino)anilino)ethyl]piperazin-1-yl]-2-(4-methylsulfonylphenyl)acetamide Traditional Name: N-[4-[2-(N-(cyclohexanecarbonylamino)anilino)ethyl]piperazino]-2-(4-mesylphenyl)acetamide Formula: C28H39N5O4S MolecularWeight: 541.70536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)NN2CCN(CC2)CCN(C3=CC=CC=C3)NC(=O)C4CCCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(=O)NN2CCN(CC2)CCN(C3=CC=CC=C3)NC(=O)C4CCCCC4

InChI

InChI=1S/C28H39N5O4S/c1-38(36,37)26-14-12-23(13-15-26)22-27(34)29-32-19-16-31(17-20-32)18-21-33(25-10-6-3-7-11-25)30-28(35)24-8-4-2-5-9-24/h3,6-7,10-15,24H,2,4-5,8-9,16-22H2,1H3,(H,29,34)(H,30,35)