2-(2-methylprop-2-enylamino)-N-[2-[[2-[(4-methylsulfanylphenyl)carbonylamino]cyclohexyl]amino]-2-oxidanylidene-ethyl]-5-(trifluoromethyl)benzamide

Systemtic Name: 2-(2-methylprop-2-enylamino)-N-[2-[[2-[(4-methylsulfanylphenyl)carbonylamino]cyclohexyl]amino]-2-oxidanylidene-ethyl]-5-(trifluoromethyl)benzamide Openeye Name: 2-(2-methylallylamino)-N-[2-[[2-[(4-methylsulfanylbenzoyl)amino]cyclohexyl]amino]-2-oxo-ethyl]-5-(trifluoromethyl)benzamide CAS Name: 2-(2-methylprop-2-enylamino)-N-[2-[[2-[[[4-(methylthio)phenyl]-oxomethyl]amino]cyclohexyl]amino]-2-oxoethyl]-5-(trifluoromethyl)benzamide IUPAC Name: 2-(2-methylprop-2-enylamino)-N-[2-[[2-[(4-methylsulfanylbenzoyl)amino]cyclohexyl]amino]-2-oxoethyl]-5-(trifluoromethyl)benzamide Traditional Name: N-[2-keto-2-[[2-[[4-(methylthio)benzoyl]amino]cyclohexyl]amino]ethyl]-2-(2-methylallylamino)-5-(trifluoromethyl)benzamide Formula: C28H33F3N4O3S MolecularWeight: 562.64683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC1=C(C=C(C=C1)C(F)(F)F)C(=O)NCC(=O)NC2CCCCC2NC(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(=C)CNC1=C(C=C(C=C1)C(F)(F)F)C(=O)NCC(=O)NC2CCCCC2NC(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C28H33F3N4O3S/c1-17(2)15-32-22-13-10-19(28(29,30)31)14-21(22)27(38)33-16-25(36)34-23-6-4-5-7-24(23)35-26(37)18-8-11-20(39-3)12-9-18/h8-14,23-24,32H,1,4-7,15-16H2,2-3H3,(H,33,38)(H,34,36)(H,35,37)