2-[2-[(3R)-2-(phenylcarbonyl)-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]phenoxy]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[2-[(3R)-2-(phenylcarbonyl)-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]phenoxy]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[2-[(3R)-2-benzoyl-5-(2-thienyl)-3,4-dihydropyrazol-3-yl]phenoxy]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[2-[(3R)-2-benzoyl-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]phenoxy]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[2-[(3R)-2-benzoyl-5-thiophen-2-yl-3,4-dihydropyrazol-3-yl]phenoxy]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[2-[(3R)-2-benzoyl-5-(2-thienyl)-2-pyrazolin-3-yl]phenoxy]-1-pyrrolidino-ethanone Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=CC=CC=C2C3CC(=NN3C(=O)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C(=O)COC2=CC=CC=C2[C@H]3CC(=NN3C(=O)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C26H25N3O3S/c30-25(28-14-6-7-15-28)18-32-23-12-5-4-11-20(23)22-17-21(24-13-8-16-33-24)27-29(22)26(31)19-9-2-1-3-10-19/h1-5,8-13,16,22H,6-7,14-15,17-18H2/t22-/m1/s1