N-[4-[[3-chloranyl-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]phenyl]-2,6-bis(fluoranyl)benzamide

Systemtic Name: N-[4-[[3-chloranyl-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]phenyl]-2,6-bis(fluoranyl)benzamide Openeye Name: N-[4-[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]phenyl]-2,6-difluoro-benzamide CAS Name: N-[4-[[[[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]thio]amino]-oxomethyl]amino]phenyl]-2,6-difluorobenzamide IUPAC Name: N-[4-[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]sulfanylcarbamoylamino]phenyl]-2,6-difluorobenzamide Traditional Name: N-[4-[[[3-chloro-4-[cyclohexyl(methyl)amino]phenyl]thio]carbamoylamino]phenyl]-2,6-difluoro-benzamide Formula: C27H27ClF2N4O2S MolecularWeight: 545.043686

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C=C(C=C2)SNC(=O)NC3=CC=C(C=C3)NC(=O)C4=C(C=CC=C4F)F)Cl

Isomeric SMILES

CN(C1CCCCC1)C2=C(C=C(C=C2)SNC(=O)NC3=CC=C(C=C3)NC(=O)C4=C(C=CC=C4F)F)Cl

InChI

InChI=1S/C27H27ClF2N4O2S/c1-34(19-6-3-2-4-7-19)24-15-14-20(16-21(24)28)37-33-27(36)32-18-12-10-17(11-13-18)31-26(35)25-22(29)8-5-9-23(25)30/h5,8-16,19H,2-4,6-7H2,1H3,(H,31,35)(H2,32,33,36)