1-cyclohexyl-3-[4-[2-[1-(3-fluorophenyl)-3-oxidanylidene-1H-isoindol-2-yl]ethyl]phenyl]sulfonyl-urea

Systemtic Name: 1-cyclohexyl-3-[4-[2-[1-(3-fluorophenyl)-3-oxidanylidene-1H-isoindol-2-yl]ethyl]phenyl]sulfonyl-urea Openeye Name: 1-cyclohexyl-3-[4-[2-[1-(3-fluorophenyl)-3-oxo-isoindolin-2-yl]ethyl]phenyl]sulfonyl-urea CAS Name: 1-cyclohexyl-3-[4-[2-[1-(3-fluorophenyl)-3-oxo-1H-isoindol-2-yl]ethyl]phenyl]sulfonylurea IUPAC Name: 1-cyclohexyl-3-[4-[2-[1-(3-fluorophenyl)-3-oxo-1H-isoindol-2-yl]ethyl]phenyl]sulfonylurea Traditional Name: 1-cyclohexyl-3-[4-[2-[1-(3-fluorophenyl)-3-keto-isoindolin-2-yl]ethyl]phenyl]sulfonyl-urea Formula: C29H30FN3O4S MolecularWeight: 535.629603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCN3C(C4=CC=CC=C4C3=O)C5=CC(=CC=C5)F

Isomeric SMILES

C1CCC(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCN3C(C4=CC=CC=C4C3=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C29H30FN3O4S/c30-22-8-6-7-21(19-22)27-25-11-4-5-12-26(25)28(34)33(27)18-17-20-13-15-24(16-14-20)38(36,37)32-29(35)31-23-9-2-1-3-10-23/h4-8,11-16,19,23,27H,1-3,9-10,17-18H2,(H2,31,32,35)