1-[4-[bis(fluoranyl)methoxy]phenyl]-3-[3-[[[4-[bis(fluoranyl)methoxy]phenyl]carbamothioylamino]methyl]-3,5,5-trimethyl-cyclohexyl]thiourea

Systemtic Name: 1-[4-[bis(fluoranyl)methoxy]phenyl]-3-[3-[[[4-[bis(fluoranyl)methoxy]phenyl]carbamothioylamino]methyl]-3,5,5-trimethyl-cyclohexyl]thiourea Openeye Name: 1-[4-(difluoromethoxy)phenyl]-3-[3-[[[4-(difluoromethoxy)phenyl]carbamothioylamino]methyl]-3,5,5-trimethyl-cyclohexyl]thiourea CAS Name: 1-[3-[[[[4-(difluoromethoxy)anilino]-sulfanylidenemethyl]amino]methyl]-3,5,5-trimethylcyclohexyl]-3-[4-(difluoromethoxy)phenyl]thiourea IUPAC Name: 1-[4-(difluoromethoxy)phenyl]-3-[3-[[[4-(difluoromethoxy)phenyl]carbamothioylamino]methyl]-3,5,5-trimethylcyclohexyl]thiourea Traditional Name: 1-[4-(difluoromethoxy)phenyl]-3-[3-[[[4-(difluoromethoxy)phenyl]thiocarbamoylamino]methyl]-3,5,5-trimethyl-cyclohexyl]thiourea Formula: C26H32F4N4O2S2 MolecularWeight: 572.681493

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)CNC(=S)NC2=CC=C(C=C2)OC(F)F)NC(=S)NC3=CC=C(C=C3)OC(F)F)C

Isomeric SMILES

CC1(CC(CC(C1)(C)CNC(=S)NC2=CC=C(C=C2)OC(F)F)NC(=S)NC3=CC=C(C=C3)OC(F)F)C

InChI

InChI=1S/C26H32F4N4O2S2/c1-25(2)12-18(34-24(38)33-17-6-10-20(11-7-17)36-22(29)30)13-26(3,14-25)15-31-23(37)32-16-4-8-19(9-5-16)35-21(27)28/h4-11,18,21-22H,12-15H2,1-3H3,(H2,31,32,37)(H2,33,34,38)