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

Systemtic Name: N-[2-[[2-[(4-methylsulfonylphenyl)carbonylamino]cyclohexyl]amino]-2-oxidanylidene-ethyl]-2-(propan-2-ylcarbamoylamino)-5-(trifluoromethyl)benzamide Openeye Name: 2-(isopropylcarbamoylamino)-N-[2-[[2-[(4-methylsulfonylbenzoyl)amino]cyclohexyl]amino]-2-oxo-ethyl]-5-(trifluoromethyl)benzamide CAS Name: N-[2-[[2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]cyclohexyl]amino]-2-oxoethyl]-2-[[oxo-(propan-2-ylamino)methyl]amino]-5-(trifluoromethyl)benzamide IUPAC Name: N-[2-[[2-[(4-methylsulfonylbenzoyl)amino]cyclohexyl]amino]-2-oxoethyl]-2-(propan-2-ylcarbamoylamino)-5-(trifluoromethyl)benzamide Traditional Name: 2-(isopropylcarbamoylamino)-N-[2-keto-2-[[2-[(4-mesylbenzoyl)amino]cyclohexyl]amino]ethyl]-5-(trifluoromethyl)benzamide Formula: C28H34F3N5O6S MolecularWeight: 625.65967

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=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

CC(C)NC(=O)NC1=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/C28H34F3N5O6S/c1-16(2)33-27(40)36-21-13-10-18(28(29,30)31)14-20(21)26(39)32-15-24(37)34-22-6-4-5-7-23(22)35-25(38)17-8-11-19(12-9-17)43(3,41)42/h8-14,16,22-23H,4-7,15H2,1-3H3,(H,32,39)(H,34,37)(H,35,38)(H2,33,36,40)