N-(cyclohexylcarbamoyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(cyclohexylcarbamoyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-3-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(cyclohexylcarbamoyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(cyclohexylcarbamoyl)-3-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]propionamide Formula: C21H29F3N4O4S MolecularWeight: 490.53957

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)CCN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H29F3N4O4S/c22-21(23,24)16-6-8-18(9-7-16)33(31,32)28-14-12-27(13-15-28)11-10-19(29)26-20(30)25-17-4-2-1-3-5-17/h6-9,17H,1-5,10-15H2,(H2,25,26,29,30)