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

Systemtic Name: 1-[4-[2-[1-(3-fluorophenyl)-3-oxidanylidene-1H-isoindol-2-yl]ethyl]phenyl]sulfonyl-3-piperidin-1-yl-urea Openeye Name: 1-[4-[2-[1-(3-fluorophenyl)-3-oxo-isoindolin-2-yl]ethyl]phenyl]sulfonyl-3-(1-piperidyl)urea CAS Name: 1-[4-[2-[1-(3-fluorophenyl)-3-oxo-1H-isoindol-2-yl]ethyl]phenyl]sulfonyl-3-(1-piperidinyl)urea IUPAC Name: 1-[4-[2-[1-(3-fluorophenyl)-3-oxo-1H-isoindol-2-yl]ethyl]phenyl]sulfonyl-3-piperidin-1-ylurea Traditional Name: 1-[4-[2-[1-(3-fluorophenyl)-3-keto-isoindolin-2-yl]ethyl]phenyl]sulfonyl-3-piperidino-urea Formula: C28H29FN4O4S MolecularWeight: 536.617663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC(=O)NS(=O)(=O)C2=CC=C(C=C2)CCN3C(C4=CC=CC=C4C3=O)C5=CC(=CC=C5)F

Isomeric SMILES

C1CCN(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/C28H29FN4O4S/c29-22-8-6-7-21(19-22)26-24-9-2-3-10-25(24)27(34)33(26)18-15-20-11-13-23(14-12-20)38(36,37)31-28(35)30-32-16-4-1-5-17-32/h2-3,6-14,19,26H,1,4-5,15-18H2,(H2,30,31,35)