2-azanyl-N-[2-[[4-[(4-methylsulfanylphenyl)carbonylamino]piperidin-3-yl]amino]-2-oxidanylidene-ethyl]-5-(trifluoromethyl)benzamide

Systemtic Name: 2-azanyl-N-[2-[[4-[(4-methylsulfanylphenyl)carbonylamino]piperidin-3-yl]amino]-2-oxidanylidene-ethyl]-5-(trifluoromethyl)benzamide Openeye Name: 2-amino-N-[2-[[4-[(4-methylsulfanylbenzoyl)amino]-3-piperidyl]amino]-2-oxo-ethyl]-5-(trifluoromethyl)benzamide CAS Name: 2-amino-N-[2-[[4-[[[4-(methylthio)phenyl]-oxomethyl]amino]-3-piperidinyl]amino]-2-oxoethyl]-5-(trifluoromethyl)benzamide IUPAC Name: 2-amino-N-[2-[[4-[(4-methylsulfanylbenzoyl)amino]piperidin-3-yl]amino]-2-oxoethyl]-5-(trifluoromethyl)benzamide Traditional Name: 2-amino-N-[2-keto-2-[[4-[[4-(methylthio)benzoyl]amino]-3-piperidyl]amino]ethyl]-5-(trifluoromethyl)benzamide Formula: C23H26F3N5O3S MolecularWeight: 509.54445

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NC2CCNCC2NC(=O)CNC(=O)C3=C(C=CC(=C3)C(F)(F)F)N

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NC2CCNCC2NC(=O)CNC(=O)C3=C(C=CC(=C3)C(F)(F)F)N

InChI

InChI=1S/C23H26F3N5O3S/c1-35-15-5-2-13(3-6-15)21(33)31-18-8-9-28-11-19(18)30-20(32)12-29-22(34)16-10-14(23(24,25)26)4-7-17(16)27/h2-7,10,18-19,28H,8-9,11-12,27H2,1H3,(H,29,34)(H,30,32)(H,31,33)