(E)-2-(3-cyclopropyl-4-cyclopropylsulfonyl-phenyl)-N-(1-methylpyrazol-3-yl)-3-[(1S)-3-oxidanylidenecyclopentyl]prop-2-enamide

Systemtic Name: (E)-2-(3-cyclopropyl-4-cyclopropylsulfonyl-phenyl)-N-(1-methylpyrazol-3-yl)-3-[(1S)-3-oxidanylidenecyclopentyl]prop-2-enamide Openeye Name: (E)-2-(3-cyclopropyl-4-cyclopropylsulfonyl-phenyl)-N-(1-methylpyrazol-3-yl)-3-[(1S)-3-oxocyclopentyl]prop-2-enamide CAS Name: (E)-2-(3-cyclopropyl-4-cyclopropylsulfonylphenyl)-N-(1-methyl-3-pyrazolyl)-3-[(1S)-3-oxocyclopentyl]-2-propenamide IUPAC Name: (E)-2-(3-cyclopropyl-4-cyclopropylsulfonylphenyl)-N-(1-methylpyrazol-3-yl)-3-[(1S)-3-oxocyclopentyl]prop-2-enamide Traditional Name: (E)-2-(3-cyclopropyl-4-cyclopropylsulfonyl-phenyl)-3-[(1S)-3-ketocyclopentyl]-N-(1-methylpyrazol-3-yl)acrylamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C(=CC2CCC(=O)C2)C3=CC(=C(C=C3)S(=O)(=O)C4CC4)C5CC5

Isomeric SMILES

CN1C=CC(=N1)NC(=O)/C(=C/[C@H]2CCC(=O)C2)/C3=CC(=C(C=C3)S(=O)(=O)C4CC4)C5CC5

InChI

InChI=1S/C24H27N3O4S/c1-27-11-10-23(26-27)25-24(29)21(13-15-2-6-18(28)12-15)17-5-9-22(20(14-17)16-3-4-16)32(30,31)19-7-8-19/h5,9-11,13-16,19H,2-4,6-8,12H2,1H3,(H,25,26,29)/b21-13+/t15-/m0/s1