N-[2-[[2-[(4-methylsulfonylphenyl)carbonylamino]cyclohexyl]amino]-2-oxidanylidene-ethyl]-2-(propylamino)-5-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[[2-[(4-methylsulfonylphenyl)carbonylamino]cyclohexyl]amino]-2-oxidanylidene-ethyl]-2-(propylamino)-5-(trifluoromethyl)benzamide Openeye Name: N-[2-[[2-[(4-methylsulfonylbenzoyl)amino]cyclohexyl]amino]-2-oxo-ethyl]-2-(propylamino)-5-(trifluoromethyl)benzamide CAS Name: N-[2-[[2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]cyclohexyl]amino]-2-oxoethyl]-2-(propylamino)-5-(trifluoromethyl)benzamide IUPAC Name: N-[2-[[2-[(4-methylsulfonylbenzoyl)amino]cyclohexyl]amino]-2-oxoethyl]-2-(propylamino)-5-(trifluoromethyl)benzamide Traditional Name: N-[2-keto-2-[[2-[(4-mesylbenzoyl)amino]cyclohexyl]amino]ethyl]-2-(propylamino)-5-(trifluoromethyl)benzamide Formula: C27H33F3N4O5S MolecularWeight: 582.63493

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)C(F)(F)F)C(=O)NCC(=O)NC2CCCCC2NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCNC1=C(C=C(C=C1)C(F)(F)F)C(=O)NCC(=O)NC2CCCCC2NC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C27H33F3N4O5S/c1-3-14-31-21-13-10-18(27(28,29)30)15-20(21)26(37)32-16-24(35)33-22-6-4-5-7-23(22)34-25(36)17-8-11-19(12-9-17)40(2,38)39/h8-13,15,22-23,31H,3-7,14,16H2,1-2H3,(H,32,37)(H,33,35)(H,34,36)