1-[[(3E)-6-fluoranyl-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[(3E)-6-fluoranyl-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]methyl]-3-propan-2-yl-urea Openeye Name: 1-[[(3E)-6-fluoro-2-methyl-3-[(4-methylsulfonylphenyl)methylene]inden-1-yl]methyl]-3-isopropyl-urea CAS Name: 1-[[(3E)-6-fluoro-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]-1-indenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[(3E)-6-fluoro-2-methyl-3-[(4-methylsulfonylphenyl)methylidene]inden-1-yl]methyl]-3-propan-2-ylurea Traditional Name: 1-[[(3E)-6-fluoro-3-(4-mesylbenzylidene)-2-methyl-inden-1-yl]methyl]-3-isopropyl-urea Formula: C23H25FN2O3S MolecularWeight: 428.519603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)(=O)C)C=CC(=C2)F)CNC(=O)NC(C)C

Isomeric SMILES

CC\1=C(C2=C(/C1=C/C3=CC=C(C=C3)S(=O)(=O)C)C=CC(=C2)F)CNC(=O)NC(C)C

InChI

InChI=1S/C23H25FN2O3S/c1-14(2)26-23(27)25-13-22-15(3)20(19-10-7-17(24)12-21(19)22)11-16-5-8-18(9-6-16)30(4,28)29/h5-12,14H,13H2,1-4H3,(H2,25,26,27)/b20-11+