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

Systemtic Name: 1-cyclohexyl-3-[4-[2-[1-(4-fluorophenyl)-3-oxidanylidene-1H-isoindol-2-yl]ethyl]phenyl]sulfonyl-urea Openeye Name: 1-cyclohexyl-3-[4-[2-[1-(4-fluorophenyl)-3-oxo-isoindolin-2-yl]ethyl]phenyl]sulfonyl-urea CAS Name: 1-cyclohexyl-3-[4-[2-[1-(4-fluorophenyl)-3-oxo-1H-isoindol-2-yl]ethyl]phenyl]sulfonylurea IUPAC Name: 1-cyclohexyl-3-[4-[2-[1-(4-fluorophenyl)-3-oxo-1H-isoindol-2-yl]ethyl]phenyl]sulfonylurea Traditional Name: 1-cyclohexyl-3-[4-[2-[1-(4-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=C(C=C5)F

Isomeric SMILES

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

InChI

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